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

*Links on SpectraBase are not permalinks.
heptyl 4-{[(2-chloro-4,5-difluoroanilino)carbonyl]amino}benzoate
SpectraBase Compound ID 6f6vkpPnTfR
InChI InChI=1S/C21H23ClF2N2O3/c1-2-3-4-5-6-11-29-20(27)14-7-9-15(10-8-14)25-21(28)26-19-13-18(24)17(23)12-16(19)22/h7-10,12-13H,2-6,11H2,1H3,(H2,25,26,28)
InChIKey XHZQTCZKWIRTJY-UHFFFAOYSA-N
Mol Weight 424.88 g/mol
Molecular Formula C21H23ClF2N2O3
Exact Mass 424.136527 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 GBaoh5NGXfh
Name heptyl 4-{[(2-chloro-4,5-difluoroanilino)carbonyl]amino}benzoate
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/C21H23ClF2N2O3/c1-2-3-4-5-6-11-29-20(27)14-7-9-15(10-8-14)25-21(28)26-19-13-18(24)17(23)12-16(19)22/h7-10,12-13H,2-6,11H2,1H3,(H2,25,26,28)
InChIKey XHZQTCZKWIRTJY-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5906
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: 62456; UBI_ID: UBI-005908
Temperature 308 °C