| SpectraBase Spectrum ID |
APW6D0K7TiS |
| Name |
Carbonic acid, monoamide, N-hept-2-yl-, allyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
199.157228918 u |
| Formula |
C11H21NO2 |
| InChI |
InChI=1S/C11H21NO2/c1-4-6-7-8-10(3)12-11(13)14-9-5-2/h5,10H,2,4,6-9H2,1,3H3,(H,12,13) |
| InChIKey |
NCMCSYKQNJUMPX-UHFFFAOYSA-N |
| Molecular Weight |
199.294 g/mol |
| SMILES |
C(CC(C)NC(OCC=C)=O)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93314 |
