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KNIGHTOL_ACETATE;(-)-(1-S,7-R,8-R,3-E,11-E)-7,8-EPOXYCEMBRA-3,11,15-(17)-TRIEN-18-OL-ACETATE
SpectraBase Compound ID F2eFYhYfgPh
InChI InChI=1S/C22H34O3/c1-16(2)20-11-8-17(3)7-6-14-22(5)21(25-22)13-10-19(9-12-20)15-24-18(4)23/h7,9,20-21H,1,6,8,10-15H2,2-5H3/b17-7+,19-9+/t20-,21+,22+/m0/s1
InChIKey SQOZKUOMCHPMST-ZRWNGRASSA-N
Mol Weight 346.5 g/mol
Molecular Formula C22H34O3
Exact Mass 346.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 153o4owZNI
Name 1-(1'-Methylvinyl)-4-(acetoxymethyl)-7,8-epoxy-12-methylcyclotetradeca-3,11-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O3
InChI InChI=1S/C22H34O3/c1-16(2)20-11-8-17(3)7-6-14-22(5)21(25-22)13-10-19(9-12-20)15-24-18(4)23/h7,9,20-21H,1,6,8,10-15H2,2-5H3/b17-7+,19-9+/t20-,21+,22+/m0/s1
InChIKey SQOZKUOMCHPMST-ZRWNGRASSA-N
Molecular Weight 346.511 g/mol
SMILES [C@@]12(O[C@@]1(CC\C(=C/C[C@](CC\C(=C\CC2)C)(C(=C)C)[H])COC(=O)C)[H])C
SPLASH splash10-05mo-9300000000-6a4e05e9ca66b9475c34
Source of Spectrum G4-72-1600-2
Synonyms Acetic acid (4E,10E)-(1R,7S,15R)-7-isopropenyl-10,14-dimethyl-15-oxa-bicyclo[12.1.0]pentadeca-4,10-dien-4-ylmethyl ester Knightol-acetate Acetic acid [(1R,4E,7S,10E,14R)-10,14-dimethyl-7-(1-methylethenyl)-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl ester [(1R,4E,7S,10E,14R)-10,14-dimethyl-7-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl acetate [(1R,4E,7S,10E,14R)-7-isopropenyl-10,14-dimethyl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl acetate [(1R,4E,7S,10E,14R)-10,14-dimethyl-7-prop-1-en-2-yl-15-oxabicyclo[12.1.0]pentadeca-4,10-dien-4-yl]methyl ethanoate
Wiley ID 1702183