Chemical Composition Of Agarwood Oil Cvh1

CHEMICAL COMPOSITION OF AGARWOOD OIL – AQUILARIA CRASSNA Instrument: GCMS Agilent 6890N (USA), Shimadzu QP 2010 (Japan) Library database: Nist98.L, Wiley7n.1; Nist27, Nist147, Wiley7, Szterp Sample: Agarwood essential oil supplied by SECOIN CO., LTD. Sample code: Cvh Source tree: Aquilaria crassna Pierre ex Lecomte, Phuc Trach commune, Huong Khe district, Ha Tinh province, Vietnam Operators: Dr. Nguyen thi Minh Tu, Master Ho thi My Dung (Hanoi University of Technology) Date: 28 April 2006 Technically interpreted by: SECOIN CO., LTD.

No.

IUPAC name & preferred common names (*)

Content (%)

1

Ethyl hexadecanoate; Hexadecanoic acid, ethyl ester; Ethyl palmitate; Palmitic acid, ethyl ester; FEMA No. 2451; EINECS 211-064-6; NSC8918;

13.12

2

3

Hexadecanoic acid; Palmitate; Cetylic acid; n-Hexadecanoic acid; Hexadecylic acid; hexadecanoate; palmitic acid; Hydrofol; Emersol 140; Hystrene 8016; Pentadecanecarboxylic acid; FEMA No. 2832; EINECS 200-312-9; CHEMBANK831770; C16H32O2 10-epi-gamma-Eudesmol;2-(4a,8-dimethyl1,2,3,4,4a,5,6,7-octahydronaphthalen-2-yl)propan-2ol;gamma-Eudesmol;2-Naphthalenemethanol, 1,2,3,4,4a,5,6,7-octahydro-alpha,alpha,4a,8-tetramethyl-, (2R-cis)-; ......

12.14

10.71

1

Molec. Formula/ Weight (g/mol)

Structural Formula

CAS #

628-97-7

C18H36O2/ 284.477

Palmitic acid

57-10-3

C16H32O2/ 256.424

99, Enzyme Inhibitors, Healthy wood,

1209-71-8

C15H26O/ 222.366

Notes

99, Sesquiterpene, Eudesmane; Filaria,

473-16-5

C15H26O/ 222.366

91, Sesquiterpenes, Nist 98.L, Wiley7

5.45

41114-00-5

C17H34O2/ 270.451

90, Nist 98.L; Wiley7

6

Guaiol;2-(3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen5-yl)propan-2-ol; Champacol; Guaiac alcohol; Champaca camphor; Guai-1(5)-en-11-ol; NSC 19941; EINECS 207702-8; 2-((3S,8S)-1,2,3,4,5,6,7,8-Octahydro-3,8dimethylazulen-5-yl)propan-2-ol; ....

5.45

489-86-1 13822-35-0

C15H26O/ 222.366

Sesquiterpenes

7

Tetradecanoic acid; Myristic acid; Tetradecanoate; Hydrofol acid 1495; Myristate; Univol U 316S; Hystrene 9014; EINECS 208-875-2; FEMA No. 2764; HSDB 5686; NSC122834; .....

3.98

544-63-8

C14H28O2/ 228.371

96, Nist 98.L Myristic acid

8

Ethyl octadec-9-enoate ; Ethyl Oleate; Ethyl elaidate; Oleic acid, ethyl ester; 9-Octadecenoic acid, ethyl ester; EINECS 228-082-5; NISTC6114187;.....

3.97

111-62-6

C20H38O2/ 310.515

99, Nist 98.L; Wiley7 Fatty acid; Oleic acid

9

Alpha-Agarofuran; NISTR198306;

3.85

N/A

C15H24O/ 220.35

Sesquiterpenes, Szterp

3.75

5129-66-8

C16H32O2/ 256.424

81, Nist 98.L

4

alpha-Eudesmol; 2-(4a,8-dimethyl-2,3,4,5,6,8ahexahydro-1H-naphthalen-2-yl)propan-2-ol ;

6.19

5

Ethyl pentadecanoate; Pentadecanoic acid, ethyl ester; Pentadecanoic acid, ethyl ester; EINECS 255-223-8; NSC137833;…..

10

methyl 12-methyltetradecanoate; Tetradecanoic acid, 12-methyl-, methyl ester; Methyl tetradecanoate, 12methyl; 62691-05-8;

2

11

Beta-eudesmol; 2-(4a-methyl-8-methylidene-decalin-2yl)propan-2-ol; beta-Selinenol; 2-naphthalenemethanol, decahydro-alpha,alpha,4a-trimethyl-8-methylene-, (2R,4aR,8aS);

12

Ethyl tetradecanoate; Tetradecanoic acid, ethyl ester; Myristic acid, ethyl ester; Ethyl myristate; EINECS 204675-4; FEMA No. 2445; NSC 8917; ;

473-15-4

C15H26O/ 222.366

95, a new Sesquiterpene, Nist 98.L

2.69

124-06-1

C16H32O2/ 256.424

98, Nist 98.L; Wiley7; Fatty acid – Myristic acid- Myristate

13

Agaruspirol; Agarospirol; Hinesol; NSC152472; 2-(6,10-dimethyl-2-spiro[4.5]dec-9-enyl)propan-2-ol; 2-(6,10-Dimethylspiro[4.5]dec-6-en-2-yl)-2-propanol; .....

2.12

1460-73-7, 23811-08-7, 59331-07-6; 4895-33-4; 26934-83-8;

C15H26O/ 222.366

97, Sipro compounds, odour source, Nist 98.L; Nist27

14

Dihydrokaranone; 4a,5-dimethyl-3-propan-2-ylidene5,6,7,8-tetrahydro-4H-naphthalen-2-one; 2(3H)Naphthalenone, 4,4a,5,6,7,8-hexahydro-4a,5-dimethyl-3(1-methylethylidene)-, (4ar-cis)-;

2.07

19598-45-9

C15H22O/ 218.335

99, Nist98.L; Nist147

15

Hexadecene; hexadec-1-ene ; 1-Hexadecene; Cetene; alpha-Hexadecene; EINECS 248-131-4; NSC 60602;

1.65

629-73-2

C16H32/ 224.425

98, Nist98.L

16

Ethyl hexadec-9-enoate ; Ethyl 9-hexadecenoate; EINECS 260-065-8; NSC122038; 54546-22-4;

1.27

54546-22-4

C18H34O2/ 282.461

96, Nist98.L; Wiley7

17

Khusimol; 1H-3a,6-Methanoazulene-3-methanol, octahydro-7,7-dimethyl-8-methylene-, (3S(3alpha,3aalpha,6alpha,8aalpha))-;

1.07

16223-63-5

C15H24O/ 220.35

Szterp Sesquiterpene

3.17

3

18

19

1,4a-dimethyl-7-(1-methylethenyl)-2,3,4,4a,5,6,7,8octahydronaphthalene; 2-Isopropenyl-4a,8-dimethyl-1,2,3,4,4a,5,6,7octahydronaphthalene; 9-octadecenoic acid; octadec-9-enoic acid; oleic acid; Acide elaidique; Acide oleique [French]; CHEMBANK2796; trans-Oleic acid; Vopcolene 27; Wecoline OO; oleate; Elaidinsaure; acide elaidique; Elaidic acid; trans-Oleic acid; trans-Elaidic acid;… Total

1.01

192435

C15H24/ 204.351

93

0.60

8046-01-3 112-79-8(?)

C18H34O2/ 282.461

99, pharmaceutical solvent; Oleic acid

84.26

Notes: - (*) IUPAC name written in bold letter, compound names are separated by semi-colon (;) -

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