| SpectraBase Spectrum ID |
LTuWoCM4M44 |
| Name |
Phenol, 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.092914582 u |
| Formula |
C18H17NO3S |
| InChI |
InChI=1S/C18H17NO3S/c1-19(2)15-9-5-8-14-13(15)7-6-12-17(14)23(21,22)18-11-4-3-10-16(18)20/h3-12,20H,1-2H3 |
| InChIKey |
CFKZHLQHPHXEIX-UHFFFAOYSA-N |
| Molecular Weight |
327.398 g/mol |
| SMILES |
C=1(S(=O)(=O)C2=C(O)C=CC=C2)C=CC=C2C(N(C)C)=CC=CC12 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933479 |