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Methylcarbamic acid, p-tert-butylphenyl ester

View entire compound with spectra: 5 NMR, 1 FTIR, and 1 Raman

Methylcarbamic acid, p-tert-butylphenyl ester
SpectraBase Compound ID JzVf6RrYZnI
InChI InChI=1S/C12H17NO2/c1-12(2,3)9-5-7-10(8-6-9)15-11(14)13-4/h5-8H,1-4H3,(H,13,14)
InChIKey SQWINKDZQCVJNM-UHFFFAOYSA-N
Mol Weight 207.27 g/mol
Molecular Formula C12H17NO2
Exact Mass 207.125929 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 2iKSLKebjG5
Name Methylcarbamic acid, p-tert-butylphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 207.125928789 u
Formula C12H17NO2
InChI InChI=1S/C12H17NO2/c1-12(2,3)9-5-7-10(8-6-9)15-11(14)13-4/h5-8H,1-4H3,(H,13,14)
InChIKey SQWINKDZQCVJNM-UHFFFAOYSA-N
Molecular Weight 207.273 g/mol
SMILES N(C(OC=1C=CC(=CC1)C(C)(C)C)=O)C
Spectrum/Structure Validation Score (Raman) 0.976593