| SpectraBase Spectrum ID |
KK7OmPk9xSV |
| Name |
(R)-3-((R)-1-(4-Methoxyphenyl)-2-nitroethyl)-3-phenylindolin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.142307128 u |
| Formula |
C23H20N2O4 |
| InChI |
InChI=1S/C23H20N2O4/c1-29-18-13-11-16(12-14-18)20(15-25(27)28)23(17-7-3-2-4-8-17)19-9-5-6-10-21(19)24-22(23)26/h2-14,20H,15H2,1H3,(H,24,26)/t20-,23-/m1/s1 |
| InChIKey |
QIWWLHDOBSFKAH-NFBKMPQASA-N |
| Molecular Weight |
388.423 g/mol |
| SMILES |
C=1(C=CC=CC1)[C@]1(C(NC2=CC=CC=C12)=O)[C@](C[N+](=O)[O-])(C1=CC=C(C=C1)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933313 |
