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.beta.-Bisabolenal

View entire compound with spectra: 1 NMR, and 4 MS (GC)

.beta.-Bisabolenal
SpectraBase Compound ID 5zdxZEAqmF2
InChI InChI=1S/C15H22O/c1-12(2)5-4-6-13(3)15-9-7-14(11-16)8-10-15/h5,7,11,15H,3-4,6,8-10H2,1-2H3
InChIKey JZLKKMAUZMMUMS-UHFFFAOYSA-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 BbubdsVjw9r
Name .beta.-bisabolenal
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-12(2)5-4-6-13(3)15-9-7-14(11-16)8-10-15/h5,7,11,15H,3-4,6,8-10H2,1-2H3
InChIKey JZLKKMAUZMMUMS-UHFFFAOYSA-N
Molecular Weight 218.340 g/mol
SMILES C(C1CC=C(CC1)C=O)(=C)CCC=C(C)C
SPLASH splash10-014l-9200000000-027fd19919a25706fb94
Source of Spectrum QE-14-5342-2
Synonyms 4-(6-Methylhepta-1,5-dien-2-yl)-1-cyclohexenecarboxaldehyde 4-(6-Methylhepta-1,5-dien-2-yl)cyclohexene-1-carbaldehyde
Wiley ID 1692100