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(-)-(1R,3R,4S)-8-Phenylmenthylisocyanate
SpectraBase Compound ID 79QvMcjF6rf
InChI InChI=1S/C17H23NO/c1-13-9-10-15(16(11-13)18-12-19)17(2,3)14-7-5-4-6-8-14/h4-8,13,15-16H,9-11H2,1-3H3/t13-,15-,16-/m1/s1
InChIKey MLTXMTLAHLZADX-FVQBIDKESA-N
Mol Weight 257.38 g/mol
Molecular Formula C17H23NO
Exact Mass 257.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzRPIcHMF2m
Name (-)-(1R,3R,4S)-8-Phenylmenthylisocyanate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO
InChI InChI=1S/C17H23NO/c1-13-9-10-15(16(11-13)18-12-19)17(2,3)14-7-5-4-6-8-14/h4-8,13,15-16H,9-11H2,1-3H3/t13-,15-,16-/m1/s1
InChIKey MLTXMTLAHLZADX-FVQBIDKESA-N
Molecular Weight 257.377 g/mol
SMILES [C@]1([C@@](CC[C@](C1)(C)[H])(C(C)(C)c1ccccc1)[H])(N=C=O)[H]
SPLASH splash10-014i-1900000000-2df7a77ff3cd709f9cab
Source of Spectrum C5-2003-2694-8
Synonyms {1-[(1S,2R,4R)-2-isocyanato-4-methylcyclohexyl]-1-methylethyl}benzene
Wiley ID 1616228