| SpectraBase Spectrum ID |
3uVpjm0f0vw |
| Name |
ethyl 2-({[1-(1-adamantyl)-4-nitro-1H-pyrazol-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| 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/C25H30N4O5S/c1-2-34-24(31)20-17-5-3-4-6-19(17)35-23(20)26-22(30)21-18(29(32)33)13-28(27-21)25-10-14-7-15(11-25)9-16(8-14)12-25/h13-16H,2-12H2,1H3,(H,26,30)/t14-,15+,16-,25- |
| InChIKey |
JMILFSDIMJDRQV-JRVBSRRWSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_3194 |
| 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: 9315675; UBI_ID: UBI-003195 |
| Temperature |
308 °C |
![ethyl 2-({[1-(1-adamantyl)-4-nitro-1H-pyrazol-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate](/api/spectrum/3uVpjm0f0vw/structure.png?h=300&w=458 "ethyl 2-({[1-(1-adamantyl)-4-nitro-1H-pyrazol-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate")
