| SpectraBase Spectrum ID |
5O4KglwRYyo |
| Name |
(E)-2-Methoxy-3,3-dimethyl-5-(2-phenylethenyl)-3,4-dihydro-2H-pyrrole 1-oxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.141578854 u |
| Formula |
C15H19NO2 |
| InChI |
InChI=1S/C15H19NO2/c1-15(2)11-13(16(17)14(15)18-3)10-9-12-7-5-4-6-8-12/h4-10,14H,11H2,1-3H3/b10-9+ |
| InChIKey |
SMDIYMPYWLCZDA-MDZDMXLPSA-N |
| Molecular Weight |
245.322 g/mol |
| SMILES |
C1([N+](=C(CC1(C)C)\C=C\C=1C=CC=CC1)[O-])OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96267 |
