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Methylcyclohexane
SpectraBase Compound ID 6nCctHN5jr9
InChI InChI=1S/C7H14/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3
InChIKey UAEPNZWRGJTJPN-UHFFFAOYSA-N
Mol Weight 98.19 g/mol
Molecular Formula C7H14
Exact Mass 98.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5U5JHLkbS83
Name Cyclohexane, methyl-
Alternate Name(s) Cyclohexylmethane Hexahydrotoluene Hexahydroxytoluene Metylocykloheksan Sextone B Toluene hexahydride Toluene, hexahydro- Methylcyclohexane AI3-18132 EINECS 203-624-3 HSDB 98 NSC 9391 UN2296
CAS Registry Number 108-87-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14
InChI InChI=1S/C7H14/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3
InChIKey UAEPNZWRGJTJPN-UHFFFAOYSA-N
Molecular Weight 98.189 g/mol
SMILES CC1CCCCC1
SPLASH splash10-053r-9000000000-6d0507e4da1a642c1023
Source of Spectrum PR-950-0-0
Wiley ID 1119025