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SESQUIPHELLANDRENE
SpectraBase Compound ID L0n5VYnTG1P
InChI InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,10,14-15H,3,5,7,9,11H2,1-2,4H3/t14-,15+/m1/s1
InChIKey PHWISBHSBNDZDX-CABCVRRESA-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 EXM1vzBTviK
Name Sesquiphellandrene
Source of Sample SAFC Cat.no. W252204
CAS Registry Number 20307-83-9
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/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,10,14-15H,3,5,7,9,11H2,1-2,4H3/t14-,15+/m1/s1
InChIKey PHWISBHSBNDZDX-CABCVRRESA-N
Molecular Weight 204.357 g/mol
Number of Peaks 50
RI1 1523
RI2 1199
SMILES C1=C[C@@](CCC1=C)([C@@](CCC=C(C)C)(C)[H])[H]
SPLASH splash10-00kf-9200000000-e620d5b3224817ca0864
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 Cyclohexene, 3-[(1S)-1,5-dimethyl-4-hexenyl]-6-methylene-, (3R)-
Wiley ID LM_FFNSC3_1042