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

*Links on SpectraBase are not permalinks.
1-[(1,5-dimethyl-4-nitro-1H-pyrazol-3-yl)carbonyl]hexahydro-1H-azepine
SpectraBase Compound ID AHOiuJHO8av
InChI InChI=1S/C12H18N4O3/c1-9-11(16(18)19)10(13-14(9)2)12(17)15-7-5-3-4-6-8-15/h3-8H2,1-2H3
InChIKey YFFVFFCOVUVIOJ-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C12H18N4O3
Exact Mass 266.13789 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 1IUzy93qQcX
Name 1-[(1,5-dimethyl-4-nitro-1H-pyrazol-3-yl)carbonyl]hexahydro-1H-azepine
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/C12H18N4O3/c1-9-11(16(18)19)10(13-14(9)2)12(17)15-7-5-3-4-6-8-15/h3-8H2,1-2H3
InChIKey YFFVFFCOVUVIOJ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_3725
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: UZI/9184649; Labnumber: BAC_UAMK/016834; UZI_ID: UZI-003727
Temperature 308 °C