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2-Methyl-1,3-cyclohexadiene
SpectraBase Compound ID F4924BFnu2z
InChI InChI=1S/C7H10/c1-7-5-3-2-4-6-7/h3,5-6H,2,4H2,1H3
InChIKey XMWINMVFKPHMJB-UHFFFAOYSA-N
Mol Weight 94.16 g/mol
Molecular Formula C7H10
Exact Mass 94.07825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rvlSpTX8l
Name 2-Methyl-1,3-cyclohexadiene
CAS Registry Number 1489-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C7H10/c1-7-5-3-2-4-6-7/h3,5-6H,2,4H2,1H3
InChIKey XMWINMVFKPHMJB-UHFFFAOYSA-N
Molecular Weight 94.157 g/mol
SMILES C1CC=CC(=C1)C
SPLASH splash10-004i-9000000000-b7543a798078bf7ac9e0
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Cyclohexadiene<2-methyl-1,3->
Wiley ID 1886186