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Isocyanic acid, p-cumenyl ester

View entire compound with spectra: 4 NMR, 1 FTIR, 1 Raman, and 1 MS (GC)

Isocyanic acid, p-cumenyl ester
SpectraBase Compound ID 3xn1fXYYlK1
InChI InChI=1S/C10H11NO/c1-8(2)9-3-5-10(6-4-9)11-7-12/h3-6,8H,1-2H3
InChIKey PJVRNNRZWASOIT-UHFFFAOYSA-N
Mol Weight 161.2 g/mol
Molecular Formula C10H11NO
Exact Mass 161.084064 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KOPDFbUg9AS
Name 4-Isopropylphenyl isocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 439959
CAS Registry Number 31027-31-3
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11NO
InChI 1S/C10H11NO/c1-8(2)9-3-5-10(6-4-9)11-7-12/h3-6,8H,1-2H3
InChIKey PJVRNNRZWASOIT-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_009654