| SpectraBase Spectrum ID |
68OOgB2mX0p |
| Name |
benzoic acid, 3-nitro-4-(phenylthio)-, methyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.040879008 u |
| Formula |
C14H11NO4S |
| InChI |
InChI=1S/C14H11NO4S/c1-19-14(16)10-7-8-13(12(9-10)15(17)18)20-11-5-3-2-4-6-11/h2-9H,1H3 |
| InChIKey |
STFIAUKBFFALNK-UHFFFAOYSA-N |
| Molecular Weight |
289.305 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_13180 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10301279; Lab Info: LP; Lab Number: LP-0503409 |
