| SpectraBase Spectrum ID |
LHDDSXCxG9y |
| Name |
1-Butyl-5-fluoro-3-((4-methoxybenzyl) imino) indolin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.158706085 u |
| Formula |
C20H21FN2O2 |
| InChI |
InChI=1S/C20H21FN2O2/c1-3-4-11-23-18-10-7-15(21)12-17(18)19(20(23)24)22-13-14-5-8-16(25-2)9-6-14/h5-10,12H,3-4,11,13H2,1-2H3/b22-19- |
| InChIKey |
XPZIXZAQFAUVOR-QOCHGBHMSA-N |
| Molecular Weight |
340.398 g/mol |
| SMILES |
C1(N(C2=CC=C(C=C2\C1=N/CC=1C=CC(=CC1)OC)F)CCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957135 |
