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14-Acetoxy-.beta.-caryophyllene
SpectraBase Compound ID 10kpEMldpSV
InChI InChI=1S/C17H26O2/c1-12-7-6-8-14(19-13(2)18)9-10-15-16(3,4)11-17(12,15)5/h8,15H,1,6-7,9-11H2,2-5H3/b14-8-/t15-,17-/m0/s1
InChIKey GGNVTVXXIKIKFE-BYGVAPHOSA-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 8WANVuueHED
Name 14-Acetoxy-.beta.-caryophyllene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-12-7-6-8-14(19-13(2)18)9-10-15-16(3,4)11-17(12,15)5/h8,15H,1,6-7,9-11H2,2-5H3/b14-8-/t15-,17-/m0/s1
InChIKey GGNVTVXXIKIKFE-BYGVAPHOSA-N
Molecular Weight 262.393 g/mol
SMILES [C@@]12([C@](CC\C(OC(=O)C)=C\CCC2=C)([H])C(C1)(C)C)C
SPLASH splash10-03fr-9300000000-4234281564ef81443cad
Source of Spectrum F-51-3819-7
Synonyms (1S,9R)-9,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-en-4-yl acetate Acetic acid (Z)-(1S,9R)-9,11,11-trimethyl-8-methylene-bicyclo[7.2.0]undec-4-en-4-ylmethyl ester
Wiley ID 791651