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.beta.-Vetispirene
SpectraBase Compound ID ELigo9by09V
InChI InChI=1S/C15H22/c1-11(2)14-8-9-15(10-14)12(3)6-5-7-13(15)4/h5-6,13H,3,7-10H2,1-2,4H3/t13-,15+/m1/s1
InChIKey CSRZVTLTICSDRH-HIFRSBDPSA-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 ZppCpzDkmD
Name Vetispirene
CAS Registry Number 28908-27-2
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
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C15H22/c1-11(2)14-8-9-15(10-14)12(3)6-5-7-13(15)4/h5-6,13H,3,7-10H2,1-2,4H3/t13-,15+/m1/s1
InChIKey CSRZVTLTICSDRH-HIFRSBDPSA-N
Molecular Weight 202.341 g/mol
Nominal Mass 202 u
Number of Peaks 87
SMILES C1C(CC[C@@]11C(C=CC[C@]1(C)[H])=C)=C(C)C
SPLASH splash10-0a5c-6900000000-fdbd03106263309f74e8
Source ex VETIVER, SLA
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001395