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Guaiene<cis-beta->
SpectraBase Compound ID uOLNxZJ0iI
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/t11-,12-/m0/s1
InChIKey GIBQERSGRNPMEH-RYUDHWBXSA-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 AWu1BK4gzB1
Name .beta.-Guaiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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/t11-,12-/m0/s1
InChIKey GIBQERSGRNPMEH-RYUDHWBXSA-N
Instrument Name Agilent 7890A-5975C
Ionization Type EI
Literature Reference DOI 10.1002/pca.2863
Molecular Weight 204.357 g/mol
SMILES C1=2CC(CC[C@@](C2CC[C@@]1(C)[H])(C)[H])=C(C)C
SPLASH splash10-0btc-4910000000-19795d49d8dfa0a02856
Source of Spectrum PA-31-SM14-Fig. S11 F
Wiley ID 1840303