| SpectraBase Spectrum ID |
FefxBNlevZA |
| Name |
N-Dansyl-methyltryptophane |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
451.156577467 u |
| Formula |
C24H25N3O4S |
| InChI |
InChI=1S/C24H25N3O4S/c1-27(2)22-12-6-10-19-18(22)9-7-13-23(19)32(29,30)26-21(24(28)31-3)15-17-14-16-8-4-5-11-20(16)25-17/h4-14,21,25-26H,15H2,1-3H3 |
| InChIKey |
KWXOJRUSNRENRZ-UHFFFAOYSA-N |
| Molecular Weight |
451.541 g/mol |
| SMILES |
C(NS(C1=C2C(C(N(C)C)=CC=C2)=CC=C1)(=O)=O)(CC=1NC=2C=CC=CC2C1)C(=O)OC |
