| SpectraBase Spectrum ID |
5eBSagwPTzZ |
| Name |
Benzyl 7-(4-nitrophenyl)-7-oxohept-5-enylcarbamate |
| Alternate Name(s) |
(E)-benzyl (7-(4-nitrophenyl)-7-oxohept-5-en-1-yl)carbamate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22N2O5 |
| InChI |
InChI=1S/C21H22N2O5/c24-20(18-11-13-19(14-12-18)23(26)27)10-6-1-2-7-15-22-21(25)28-16-17-8-4-3-5-9-17/h3-6,8-14H,1-2,7,15-16H2,(H,22,25)/b10-6+ |
| InChIKey |
ADHXTWCHFYCRHR-UXBLZVDNSA-N |
| Literature Reference DOI |
10.1002/adsc.201100282 |
| Molecular Weight |
382.416 g/mol |
| SMILES |
N(CCCC\C=C\C(c1ccc(cc1)[N+](=O)[O-])=O)C(OCc1ccccc1)=O |
| SPLASH |
splash10-0006-9100000000-43e294145c55197ffd7b |
| Source of Spectrum |
ASC-353-2721/SM7-1j |
| Wiley ID |
1762455 |
