For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(-)-(1R,3R,4S)-8-Methylmenthylisocyanate
SpectraBase Compound ID BiryBsLcB3f
InChI InChI=1S/C12H21NO/c1-9-5-6-10(12(2,3)4)11(7-9)13-8-14/h9-11H,5-7H2,1-4H3/t9-,10-,11-/m1/s1
InChIKey RERFUIDUQGEDIP-GMTAPVOTSA-N
Mol Weight 195.31 g/mol
Molecular Formula C12H21NO
Exact Mass 195.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JGnNpL9NP5C
Name (-)-(1R,3R,4S)-8-Methylmenthylisocyanate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO
InChI InChI=1S/C12H21NO/c1-9-5-6-10(12(2,3)4)11(7-9)13-8-14/h9-11H,5-7H2,1-4H3/t9-,10-,11-/m1/s1
InChIKey RERFUIDUQGEDIP-GMTAPVOTSA-N
Molecular Weight 195.306 g/mol
SMILES [C@]1([C@@](CC[C@](C1)(C)[H])(C(C)(C)C)[H])(N=C=O)[H]
SPLASH splash10-0a4i-9100000000-cac17b184c5a0880fe00
Source of Spectrum C5-2003-2693-8
Synonyms (1S,2R,4R)-1-tert-butyl-2-isocyanato-4-methylcyclohexane
Wiley ID 1616229