| SpectraBase Spectrum ID |
1Wd48QWkKPl |
| Name |
Carbonic acid, monoamide, N-(2-bromophenyl)-, neopentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
285.036441757 u |
| Formula |
C12H16BrNO2 |
| InChI |
InChI=1S/C12H16BrNO2/c1-12(2,3)8-16-11(15)14-10-7-5-4-6-9(10)13/h4-7H,8H2,1-3H3,(H,14,15) |
| InChIKey |
QZUGQIWLGUTMDZ-UHFFFAOYSA-N |
| SMILES |
C(COC(=O)NC1=CC=CC=C1Br)(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.809482 |
