| SpectraBase Spectrum ID |
Dfn94RqsApB |
| Name |
4-{[4-allyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,5-dinitrobenzoic acid |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C19H15N5O7S/c1-3-7-22-17(11-5-4-6-13(8-11)31-2)20-21-19(22)32-16-14(23(27)28)9-12(18(25)26)10-15(16)24(29)30/h3-6,8-10H,1,7H2,2H3,(H,25,26) |
| InChIKey |
ACJIBEAKDBFLQY-UHFFFAOYSA-N |
| NMR Offset |
14.7616 |
| NMR Spectrometer Frequency |
200.133 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_7000_4155 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: NMR/8305694; Labnumber: LP-0502075; IOH_ID: IOH-004156 |
| Temperature |
297 °C |
![4-{[4-allyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,5-dinitrobenzoic acid](/api/spectrum/Dfn94RqsApB/structure.png?h=300&w=458 "4-{[4-allyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,5-dinitrobenzoic acid")
