SpectraBase Spectrum ID |
4kVkk4T6EiO |
Name |
Carbonic acid, monoamide, N-methyl-N-phenyl-, neopentyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
221.141578854 u |
Formula |
C13H19NO2 |
InChI |
InChI=1S/C13H19NO2/c1-13(2,3)10-16-12(15)14(4)11-8-6-5-7-9-11/h5-9H,10H2,1-4H3 |
InChIKey |
MYRHOBCIHCEQQE-UHFFFAOYSA-N |
Molecular Weight |
221.300 g/mol |
SMILES |
CC(COC(=O)N(C1=CC=CC=C1)C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897816 |