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trans-4-(tert-Butyl)-1-methylcyclohexyl isocyanide
SpectraBase Compound ID 41zco7sSWVK
InChI InChI=1S/C12H21N/c1-11(2,3)10-6-8-12(4,13-5)9-7-10/h10H,6-9H2,1-4H3/t10-,12-
InChIKey GKBXXVBXOPHGKF-UMSPYCQHSA-N
Mol Weight 179.31 g/mol
Molecular Formula C12H21N
Exact Mass 179.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GTvrWWCLFZ
Name trans-4-(tert-Butyl)-1-methylcyclohexyl isocyanide
Alternate Name(s) 4-tert-Butyl-1-isocyano-1-methylcyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21N
InChI InChI=1S/C12H21N/c1-11(2,3)10-6-8-12(4,13-5)9-7-10/h10H,6-9H2,1-4H3/t10-,12-
InChIKey GKBXXVBXOPHGKF-UMSPYCQHSA-N
Molecular Weight 179.307 g/mol
SMILES [C@]1([N+]#[C-])(CC[C@@](C(C)(C)C)(CC1)[H])C
SPLASH splash10-0002-9300000000-804b73b532dc511650de
Source of Spectrum SO-0-442-7
Wiley ID 864245