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1-Isocyanato-cis-5-isocyanatomethyl-3,3,5-trimethyl-cyclohexane

View entire compound with spectra: 1 NMR, and 2 Near IR

1-Isocyanato-cis-5-isocyanatomethyl-3,3,5-trimethyl-cyclohexane
SpectraBase Compound ID Inhm52GPrEv
InChI InChI=1S/C12H18N2O2/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15/h10H,4-7H2,1-3H3/t10-,12-/m0/s1
InChIKey NIMLQBUJDJZYEJ-JQWIXIFHSA-N
Mol Weight 222.29 g/mol
Molecular Formula C12H18N2O2
Exact Mass 222.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DDkaPiE6DZ0
Name 1-Isocyanato-cis-5-isocyanatomethyl-3,3,5-trimethyl-cyclohexane
CAS Registry Number 70936-97-9#
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18N2O2
InChI InChI=1S/C12H18N2O2/c1-11(2)4-10(14-9-16)5-12(3,6-11)7-13-8-15/h10H,4-7H2,1-3H3/t10-,12-/m0/s1
InChIKey NIMLQBUJDJZYEJ-JQWIXIFHSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3