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Azulene, 1,2,3,4,5,6,7,8-octahydro-1,4-dimethyl-7-(1-methylethylidene)-, (1S-cis)-
SpectraBase Compound ID 4Rnk3JxHTb5
InChI InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-12H,5-9H2,1-4H3
InChIKey GIBQERSGRNPMEH-UHFFFAOYSA-N
Mol Weight 204.36 g/mol
Molecular Formula C15H24
Exact Mass 204.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChJJqPEG2fY
Name beta-Guaiene
CAS Registry Number 88-84-6
Classification Fragrance, flavor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 204.187800773 u
Formula C15H24
InChI InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-12H,5-9H2,1-4H3
InChIKey GIBQERSGRNPMEH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 204.357 g/mol
Nominal Mass 204 u
Quality 930
Retention Index 1519
SMILES C12=C(C(CCC(C2)=C(C)C)C)CCC1C
SPLASH splash10-0rmu-4900000000-562d5ed53bac71be074d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Dimethyl-7-propan-2-ylidene-2,3,4,5,6,8-hexahydro-1H-azulene
Technique GC/MS
Wiley ID DD2024_008454