John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=3D6mqfLUJzN SpectraBase Spectrum ID=29h3zvjUs3S

(accessed ).
isothiocyanic acid, isobutyl ester
SpectraBase Compound ID 3D6mqfLUJzN
InChI InChI=1S/C5H9NS/c1-5(2)3-6-4-7/h5H,3H2,1-2H3
InChIKey NSDDRJXKROCWRZ-UHFFFAOYSA-N
Mol Weight 115.19 g/mol
Molecular Formula C5H9NS
Exact Mass 115.045571 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 29h3zvjUs3S
Name ISOTHIOCYANIC ACID, ISOBUTYL ESTER
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
Boiling Point 164C
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9NS
InChI InChI=1S/C5H9NS/c1-5(2)3-6-4-7/h5H,3H2,1-2H3
InChIKey NSDDRJXKROCWRZ-UHFFFAOYSA-N
Molecular Weight 115.20
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
SpectraBase Batch ID 8XA9bFN7g7O