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1,3-Cyclohexadiene, 1-(1,1-dimethylethyl)-4-propyl-
SpectraBase Compound ID ChHSAzfDED6
InChI InChI=1S/C13H22/c1-5-6-11-7-9-12(10-8-11)13(2,3)4/h7,9H,5-6,8,10H2,1-4H3
InChIKey UYCJCPAMQBLAMK-UHFFFAOYSA-N
Mol Weight 178.32 g/mol
Molecular Formula C13H22
Exact Mass 178.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2nmltAo3nc
Name 1,3-Cyclohexadiene, 1-(1,1-dimethylethyl)-4-propyl-
Alternate Name(s) 1-t-butyl-4-propylcyclohexa-1,3-diene 1-tert-Butyl-4-propyl-1,3-cyclohexadiene
CAS Registry Number 69007-67-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22
InChI InChI=1S/C13H22/c1-5-6-11-7-9-12(10-8-11)13(2,3)4/h7,9H,5-6,8,10H2,1-4H3
InChIKey UYCJCPAMQBLAMK-UHFFFAOYSA-N
Molecular Weight 178.319 g/mol
SMILES C1(=CC=C(CC1)CCC)C(C)(C)C
SPLASH splash10-03di-2900000000-5c7fe410fe5517f59640
Source of Spectrum B-31-824-0
Wiley ID 1174859