| SpectraBase Spectrum ID |
CiOhFTMCW5g |
| Name |
5-Nitro-BNT |
| Alternate Name(s) |
5-nitrobenzo[b]naphtho[2,1-d]thiophene
5-nitronaphtho[1,2-b][1]benzothiole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H9NO2S |
| InChI |
InChI=1S/C16H9NO2S/c18-17(19)14-9-13-11-6-3-4-8-15(11)20-16(13)12-7-2-1-5-10(12)14/h1-9H |
| InChIKey |
QIZKXBATUXLXTQ-UHFFFAOYSA-N |
| Molecular Weight |
279.313 g/mol |
| SMILES |
c12c(cc(N(=O)=O)c3c2cccc3)c2ccccc2s1 |
| SPLASH |
splash10-0059-0090000000-041dacd0d4460e192866 |
| Source of Spectrum |
CRT-14-963-A |
| Wiley ID |
1709909 |
