3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N,N-dihexylbenzamide

SpectraBase Compound ID	vUM4aNlD3R
InChI	InChI=1S/C25H38N4O3/c1-5-7-9-11-16-27(17-12-10-8-6-2)25(30)23-15-13-14-22(18-23)19-28-21(4)24(29(31)32)20(3)26-28/h13-15,18H,5-12,16-17,19H2,1-4H3
InChIKey	IDVCDZCQEBRDST-UHFFFAOYSA-N Google Search
Mol Weight	442.6 g/mol
Molecular Formula	C25H38N4O3
Exact Mass	442.294391 g/mol

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SpectraBase Spectrum ID	DmOEqjhQNjs
Name	3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N,N-dihexylbenzamide
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/C25H38N4O3/c1-5-7-9-11-16-27(17-12-10-8-6-2)25(30)23-15-13-14-22(18-23)19-28-21(4)24(29(31)32)20(3)26-28/h13-15,18H,5-12,16-17,19H2,1-4H3
InChIKey	IDVCDZCQEBRDST-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_30133
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: 1683676; SBI_ID: SBI-030137
Temperature	308 °C