| SpectraBase Spectrum ID |
42n0pSIe7W5 |
| Name |
2H-Pyrrol-4-ol, 3,4-dihydro-2,2-dimethyl-5-phenyl-4-(phenylmethyl)-, 1-oxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.157228918 u |
| Formula |
C19H21NO2 |
| InChI |
InChI=1S/C19H21NO2/c1-18(2)14-19(21,13-15-9-5-3-6-10-15)17(20(18)22)16-11-7-4-8-12-16/h3-12,21H,13-14H2,1-2H3 |
| InChIKey |
SBSQCPPUOWUVMG-UHFFFAOYSA-N |
| SMILES |
C1(=[N+](C(CC1(CC=1C=CC=CC1)O)(C)C)[O-])C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924424 |
