| SpectraBase Spectrum ID |
Kt85zsa3xdJ |
| Name |
3-[(1-Naphthyl)amino]-1-propanesulfonic acid, sodium salt |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
287.059208766 u |
| Formula |
C13H14NNaO3S |
| InChI |
InChI=1S/C13H15NO3S.Na/c15-18(16,17)10-4-9-14-13-8-3-6-11-5-1-2-7-12(11)13;/h1-3,5-8,14H,4,9-10H2,(H,15,16,17);/q;+1/p-1 |
| InChIKey |
HSOPFPPLFWZKJN-UHFFFAOYSA-M |
| Molecular Weight |
287.309 g/mol |
| SMILES |
[Na+].N(C1=CC=CC2=CC=CC=C12)CCCS(=O)([O-])=O |
| Spectrum/Structure Validation Score (Raman) |
0.772593 |