For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-ethyl 4-methyl 5-({[1-(1-adamantyl)-4-nitro-1H-pyrazol-3-yl]carbonyl}amino)-3-methyl-2,4-thiophenedicarboxylate
SpectraBase Compound ID LgYoR7GETTV
InChI InChI=1S/C24H28N4O7S/c1-4-35-23(31)19-12(2)17(22(30)34-3)21(36-19)25-20(29)18-16(28(32)33)11-27(26-18)24-8-13-5-14(9-24)7-15(6-13)10-24/h11,13-15H,4-10H2,1-3H3,(H,25,29)/t13-,14+,15-,24-
InChIKey QBKLXQKWXKFRSU-UYJDEUBQSA-N
Mol Weight 516.57 g/mol
Molecular Formula C24H28N4O7S
Exact Mass 516.16787 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID ayzxyDdvLz
Name 2-ethyl 4-methyl 5-({[1-(1-adamantyl)-4-nitro-1H-pyrazol-3-yl]carbonyl}amino)-3-methyl-2,4-thiophenedicarboxylate
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/C24H28N4O7S/c1-4-35-23(31)19-12(2)17(22(30)34-3)21(36-19)25-20(29)18-16(28(32)33)11-27(26-18)24-8-13-5-14(9-24)7-15(6-13)10-24/h11,13-15H,4-10H2,1-3H3,(H,25,29)/t13-,14+,15-,24-
InChIKey QBKLXQKWXKFRSU-UYJDEUBQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3125
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: 9314752; UBI_ID: UBI-003126
Temperature 318 °C