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Butylcyclooctane
SpectraBase Compound ID LL7uPZInYVT
InChI InChI=1S/C12H24/c1-2-3-9-12-10-7-5-4-6-8-11-12/h12H,2-11H2,1H3
InChIKey MBACTSHRHMTZMA-UHFFFAOYSA-N
Mol Weight 168.32 g/mol
Molecular Formula C12H24
Exact Mass 168.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DfRTYasPnNk
Name Butylcyclooctane
Alternate Name(s) Cyclooctane, butyl-
CAS Registry Number 16538-93-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24
InChI InChI=1S/C12H24/c1-2-3-9-12-10-7-5-4-6-8-11-12/h12H,2-11H2,1H3
InChIKey MBACTSHRHMTZMA-UHFFFAOYSA-N
Molecular Weight 168.324 g/mol
SMILES C1CCCCC(CC1)CCCC
SPLASH splash10-07vl-9100000000-1b53cb3ac9fe3a15396e
Source of Spectrum HE-1982-0-0
Wiley ID 1165493