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Sesquithujene <7-epi->
SpectraBase Compound ID Bpbxx6B55HM
InChI InChI=1S/C15H24/c1-11(2)6-5-7-13(4)15-9-8-12(3)14(15)10-15/h6,8,13-14H,5,7,9-10H2,1-4H3
InChIKey UCQHFDKBUHCAFR-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 9qSaOb1pGFv
Name Sesquithujene <7-epi->
Source of Sample SAFC Cat.no. W522600
CAS Registry Number 159407-35-9
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/c1-11(2)6-5-7-13(4)15-9-8-12(3)14(15)10-15/h6,8,13-14H,5,7,9-10H2,1-4H3
InChIKey UCQHFDKBUHCAFR-UHFFFAOYSA-N
Molecular Weight 204.357 g/mol
Number of Peaks 50
RI1 1387
RI2 1066
SMILES C12(C(CCC=C(C)C)C)CC=C(C2C1)C
SPLASH splash10-00kf-9400000000-68a48710f399007a22f2
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 Bicyclo[3.1.0]hex-2-ene, 5-(1,5-dimethyl-4-hexenyl)-2-methyl-
Wiley ID LM_FFNSC3_1085