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3-(Methylthio)phenyl isocyanate

View entire compound with spectra: 3 FTIR, and 1 Raman

3-(Methylthio)phenyl isocyanate
SpectraBase Compound ID 2LE6cMK5DCe
InChI InChI=1S/C8H7NOS/c1-11-8-4-2-3-7(5-8)9-6-10/h2-5H,1H3
InChIKey BKJABLMNBSVKCV-UHFFFAOYSA-N
Mol Weight 165.21 g/mol
Molecular Formula C8H7NOS
Exact Mass 165.024835 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID IDQkMXitP6q
Name 3-(Methylthio)phenyl isocyanate
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number L12008
Lot Number 10195449
CAS Registry Number 28479-19-8
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NOS
InChI InChI=1S/C8H7NOS/c1-11-8-4-2-3-7(5-8)9-6-10/h2-5H,1H3
InChIKey BKJABLMNBSVKCV-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
Molecular Weight 165.210 g/mol
Purity 96%
Source of Spectrum Bio-Rad Laboratories, Inc.
Technique ATR-Neat (DuraSamplIR II)