| SpectraBase Spectrum ID |
8ltvdWCE47O |
| Name |
(E)-.beta.-Nitro-3-isopropoxy-4-methoxystyrene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
237.100107963 u |
| Formula |
C12H15NO4 |
| InChI |
InChI=1S/C12H15NO4/c1-9(2)17-12-8-10(6-7-13(14)15)4-5-11(12)16-3/h4-9H,1-3H3/b7-6+ |
| InChIKey |
YTFURKLVKBBCQC-VOTSOKGWSA-N |
| Molecular Weight |
237.255 g/mol |
| SMILES |
C=1(OC(C)C)C=C(C=CC1OC)\C=C\[N+]([O-])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933209 |
