| SpectraBase Spectrum ID |
1o6vYH19aOw |
| Name |
Carbonic acid, monoamide, N-isobutyl-, benzyl 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/c1-10(2)8-13-12(14)15-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14) |
| InChIKey |
WMPXWCPDONGZQU-UHFFFAOYSA-N |
| Molecular Weight |
207.273 g/mol |
| SMILES |
C(OCC=1C=CC=CC1)(=O)NCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935602 |
