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Cyclohexene, 2-(3-chloropropyl)-1,3,3-trimethyl-
SpectraBase Compound ID 8FL3VU52Thn
InChI InChI=1S/C12H21Cl/c1-10-6-7-12(2,3)11(9-10)5-4-8-13/h9-10H,4-8H2,1-3H3
InChIKey PTGGIBBRJOXUTP-UHFFFAOYSA-N
Mol Weight 200.75 g/mol
Molecular Formula C12H21Cl
Exact Mass 200.133178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID u1keAxmFQU
Name Cyclohexene, 2-(3-chloropropyl)-1,3,3-trimethyl-
Alternate Name(s) 1-(3-Chloropropyl)-3,6,6-trimethyl-1-cyclohexene 3-(3',6',6'-Trimethylcyclohex-1'-en-1'-yl)propylchloride
CAS Registry Number 54344-72-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21Cl
InChI InChI=1S/C12H21Cl/c1-10-6-7-12(2,3)11(9-10)5-4-8-13/h9-10H,4-8H2,1-3H3
InChIKey PTGGIBBRJOXUTP-UHFFFAOYSA-N
Molecular Weight 200.753 g/mol
SMILES C1(=CC(C)CCC1(C)C)CCCCl
SPLASH splash10-000i-4910000000-59c2bd2cb0fde12d1acb
Source of Spectrum H-57-1121-34
Wiley ID 1197927