| SpectraBase Spectrum ID |
9uXoIHHdz5O |
| Name |
3-Hydroxy-3-(p-methoxyphenyl)-2-phenyl-3H-indole N-oxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.120843408 u |
| Formula |
C21H17NO3 |
| InChI |
InChI=1S/C21H17NO3/c1-25-17-13-11-16(12-14-17)21(23)18-9-5-6-10-19(18)22(24)20(21)15-7-3-2-4-8-15/h2-14,23H,1H3 |
| InChIKey |
CGHAGAHXVYJAQE-UHFFFAOYSA-N |
| Molecular Weight |
331.371 g/mol |
| SMILES |
C1(=[N+](C2=C(C1(C=1C=CC(=CC1)OC)O)C=CC=C2)[O-])C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92572 |
