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Bicyclo[7.2.0]undec-4-ene-4-carboxaldehyde, 11,11-dimethyl-8-methylene-, [1R-(1R*,4E,9S*)]-
SpectraBase Compound ID 927G0yMnfSn
InChI InChI=1S/C15H22O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h6,10,13-14H,1,4-5,7-9H2,2-3H3/b12-6+/t13-,14-/m1/s1
InChIKey PDGJMGSNVOPQRK-BARLUBHISA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN58jv4mitD
Name Bicyclo[7.2.0]undec-4-ene-4-carboxaldehyde, 11,11-dimethyl-8-methylene-, [1R-(1R*,4E,9S*)]-
Alternate Name(s) (1R,9S)-11,11-dimethyl-8-methylenebicyclo[7.2.0]undec-4-ene-4-carbaldehyde (E)-Betulenal Betulenal, (E)- Caryophylla-2(12),5-dien-13-al Caryophyllen-13-al
CAS Registry Number 88134-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-11-5-4-6-12(10-16)7-8-14-13(11)9-15(14,2)3/h6,10,13-14H,1,4-5,7-9H2,2-3H3/b12-6+/t13-,14-/m1/s1
InChIKey PDGJMGSNVOPQRK-BARLUBHISA-N
Molecular Weight 218.340 g/mol
SMILES [C@]12([C@](CC\C(C=O)=C/CCC2=C)([H])C(C1)(C)C)[H]
SPLASH splash10-00kf-9200000000-dd257fdbb2e3e74ccc99
Source of Spectrum H-66-1848-0
Wiley ID 1218200