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4,8-Methanoazulene, decahydro-3a,4,8a-trimethyl-7-methylene-, (3a.alpha.,4.alpha.,8.alpha.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID Eh3lWtVoXtU
InChI InChI=1S/C15H24/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h12H,1,5-10H2,2-4H3/t12-,13-,14+,15-/m0/s1
InChIKey RTONMYLSQISFQA-XQLPTFJDSA-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 I045hs3ECWp
Name Barbatene
CAS Registry Number 72346-55-5
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/c1-11-6-9-13(2)10-12(11)14(3)7-5-8-15(13,14)4/h12H,1,5-10H2,2-4H3/t12-,13-,14+,15-/m0/s1
InChIKey RTONMYLSQISFQA-XQLPTFJDSA-N
Molecular Weight 204.357 g/mol
Number of Peaks 50
RI1 1445
SMILES [C@]12([C@]([C@]3(CCC([C@@]2(C3)[H])=C)C)(CCC1)C)C
SPLASH splash10-052g-9300000000-60cc072e3119721dc9c7
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 4,8-Methanoazulene, decahydro-3a,4,8a-trimethyl-7-methylene-
Wiley ID LM_FFNSC3_2504