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

*Links on SpectraBase are not permalinks.
R-(+)-ISOCYANIC ACID, alpha-METHYLBENZYL ESTER
SpectraBase Compound ID 49TfYcuNG5e
InChI InChI=1S/C9H9NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3
InChIKey JJSCUXAFAJEQGB-UHFFFAOYSA-N
Mol Weight 147.18 g/mol
Molecular Formula C9H9NO
Exact Mass 147.068414 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 Dza4VE5v8tp
Name (1-Isocyanatoethyl)benzene
CAS Registry Number 33375-06-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO
InChI InChI=1S/C9H9NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-6,8H,1H3
InChIKey JJSCUXAFAJEQGB-UHFFFAOYSA-N
Molecular Weight 147.177 g/mol
SMILES c1cc(ccc1)C(N=C=O)C
SPLASH splash10-001i-4900000000-0e4d817d0cb6aa782f74
Source of Spectrum NP-1-3696-0
Synonyms (+)-.alpha.-Phenethyl isocyanate (R)-(+)-.alpha. Methylbenzyl isocyanate (R)-(+)-1-Phenylethyl isocyanate Benzene, (1-isocyanatoethyl)-, (R)- Isocyanic acid R-(+)-.alpha.-methylbenzyl ester
Wiley ID 1098669