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

*Links on SpectraBase are not permalinks.
1-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoyl}hexahydro-1H-azepine
SpectraBase Compound ID K2oPRAUpjiM
InChI InChI=1S/C15H18N4O4/c20-15(17-7-3-1-2-4-8-17)14-6-5-13(23-14)11-18-10-12(9-16-18)19(21)22/h5-6,9-10H,1-4,7-8,11H2
InChIKey HGTMGLWWOMIAHW-UHFFFAOYSA-N
Mol Weight 318.33 g/mol
Molecular Formula C15H18N4O4
Exact Mass 318.132805 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 6pVThR5hTwK
Name 1-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoyl}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/C15H18N4O4/c20-15(17-7-3-1-2-4-8-17)14-6-5-13(23-14)11-18-10-12(9-16-18)19(21)22/h5-6,9-10H,1-4,7-8,11H2
InChIKey HGTMGLWWOMIAHW-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18638
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/9071245; Labnumber: UGB-0007427; UZI_ID: UZI-018645
Temperature 308 °C