| SpectraBase Spectrum ID |
KVyf0WjBB32 |
| Name |
N-(3,4,5-Trimethoxyphenyl)-3,5-dinitrobenzothioamide |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15N3O7S |
| InChI |
InChI=1S/C16H15N3O7S/c1-24-13-6-10(7-14(25-2)15(13)26-3)17-16(27)9-4-11(18(20)21)8-12(5-9)19(22)23/h4-8H,1-3H3,(H,17,27) |
| InChIKey |
AFRCFMCDCRCXTR-UHFFFAOYSA-N |
| Molecular Weight |
393.370 g/mol |
| SMILES |
N(c1cc(OC)c(c(c1)OC)OC)C(c1cc(N(=O)=O)cc(N(=O)=O)c1)=S |
| SPLASH |
splash10-000i-0902000000-2dfda8610f87defe06d4 |
| Source of Spectrum |
EJ-42-38-19 |
| Wiley ID |
1676521 |
