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Macrocarpene<ar->
SpectraBase Compound ID HD0pdD5A0xc
InChI InChI=1S/C15H22/c1-12-6-8-13(9-7-12)14-5-4-10-15(2,3)11-14/h6-9,14H,4-5,10-11H2,1-3H3/t14-/m1/s1
InChIKey WTMPNKMDSOAALU-CQSZACIVSA-N
Mol Weight 202.34 g/mol
Molecular Formula C15H22
Exact Mass 202.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCsvlYYj4u
Name Macrocarpene
CAS Registry Number 847374-83-8
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 202.172150708 u
Formula C15H22
InChI InChI=1S/C15H22/c1-12-6-8-13(9-7-12)14-5-4-10-15(2,3)11-14/h6-9,14H,4-5,10-11H2,1-3H3/t14-/m1/s1
InChIKey WTMPNKMDSOAALU-CQSZACIVSA-N
Molecular Weight 202.341 g/mol
Number of Peaks 50
RI1 1530
SMILES c1(ccc(cc1)[C@@]1(CCCC(C1)(C)C)[H])C
SPLASH splash10-0pb9-4920000000-7d4a96fcc44ccdc1313f
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 benzena, 1-[(1R)-3,3-dimethylcyclohexenyl]-4-methyl-
Wiley ID LM_FFNSC3_2543