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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 8xuM3L8Hbze
Name Guaiene
CAS Registry Number 88-84-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. 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/t11-,12-/m0/s1
InChIKey GIBQERSGRNPMEH-RYUDHWBXSA-N
Molecular Weight 204.357 g/mol
Number of Peaks 50
RI1 1498
SMILES CC(C)=C1CC[C@@](C=2CC[C@@](C2C1)(C)[H])(C)[H]
SPLASH splash10-06r6-7910000000-fe94485cee28e385bb1b
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms azulene, 1,2,3,4,5,6,7,8,-octahydro-1,4-dimethyl-7-(1-methylethylidene)-, (1S-cis)-
Wiley ID LM_FFNSC3_2561