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(E)-.beta.-Santalol acetate
SpectraBase Compound ID DRKCEK94Z7v
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h6,15-16H,2,5,7-11H2,1,3-4H3/b12-6+/t15-,16+,17+/m1/s1
InChIKey RCFGRZLLBGMERD-DQRCMHBESA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fn68BGHGUA
Name 2-Pentenoic acid, 2-methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-, ethyl ester, [1.alpha.,2.beta.(E),4.alpha.]-(.+-.)-
CAS Registry Number 73838-33-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h6,15-16H,2,5,7-11H2,1,3-4H3/b12-6+/t15-,16+,17+/m1/s1
InChIKey RCFGRZLLBGMERD-DQRCMHBESA-N
Molecular Weight 262.393 g/mol
SMILES C1([C@@]([C@]2([H])C[C@]1(CC2)[H])(CC\C=C\(COC(=O)C)C)C)=C
SPLASH splash10-0006-7900000000-806fa33078e43f3534bd
Source of Spectrum H-64-30-0
Synonyms (2E)-2-methyl-5-[(1R,2R,4R)-2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl]-2-pentenyl acetate (E)-2-Methyl-5-(2exo-methyl-3-methylidene-bicyclo[2.2.1]hept-2-yl)-2-pentenyl acetate Acetic acid[(E)-2-methyl-5-[(1R,2R,4S)-2-methyl-3-methylene-norbornan-2-yl]pent-2-enyl]ester Acetic acid[(E)-2-methyl-5-[(1S,3R,4R)-3-methyl-2-methylene-3-bicyclo[2.2.1]heptanyl]pent-2-enyl]ester [(E)-2-methyl-5-[(1R,2R,4S)-2-methyl-3-methylene-norbornan-2-yl]pent-2-enyl]acetate [(E)-2-methyl-5-[(1S,3R,4R)-3-methyl-2-methylidene-3-bicyclo[2.2.1]heptanyl]pent-2-enyl]acetate [(E)-2-methyl-5-[(1S,3R,4R)-3-methyl-2-methylidene-3-bicyclo[2.2.1]heptanyl]pent-2-enyl]ethanoate Acetic acid [(E)-2-methyl-5-[(1S,3R,4R)-3-methyl-2-methylene-3-bicyclo[2.2.1]heptanyl]pent-2-enyl] ester [(E)-2-methyl-5-[(1S,3R,4R)-3-methyl-2-methylidene-3-bicyclo[2.2.1]heptanyl]pent-2-enyl] acetate [(E)-2-methyl-5-[(1R,2R,4S)-2-methyl-3-methylene-norbornan-2-yl]pent-2-enyl] acetate [(E)-2-methyl-5-[(1S,3R,4R)-3-methyl-2-methylidene-3-bicyclo[2.2.1]heptanyl]pent-2-enyl] ethanoate
Wiley ID 1266299