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3,5,5-Trimethylcyclohexene
SpectraBase Compound ID CQD44ot2OZ0
InChI InChI=1S/C9H16/c1-8-5-4-6-9(2,3)7-8/h4-5,8H,6-7H2,1-3H3
InChIKey CBERVMGFVLWZSU-UHFFFAOYSA-N
Mol Weight 124.23 g/mol
Molecular Formula C9H16
Exact Mass 124.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3q2rGnEoHw
Name Cyclohexene<3,5,5-trimethyl->
CAS Registry Number 933-12-0
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 124.125200515 u
Formula C9H16
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/C9H16/c1-8-5-4-6-9(2,3)7-8/h4-5,8H,6-7H2,1-3H3
InChIKey CBERVMGFVLWZSU-UHFFFAOYSA-N
Molecular Weight 124.227 g/mol
Nominal Mass 124 u
Number of Peaks 53
SMILES CC1(C)CC(C)C=CC1
SPLASH splash10-014i-9200000000-083b0164e263fe325aaa
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001513