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

*Links on SpectraBase are not permalinks.
benzoic acid, 4-[5-[(2,4-dichlorophenyl)-4-morpholinylmethyl]-1H-tetrazol-1-yl]-, ethyl ester
SpectraBase Compound ID 8IuPv7cV4ML
InChI InChI=1S/C21H21Cl2N5O3/c1-2-31-21(29)14-3-6-16(7-4-14)28-20(24-25-26-28)19(27-9-11-30-12-10-27)17-8-5-15(22)13-18(17)23/h3-8,13,19H,2,9-12H2,1H3
InChIKey WPHALTHRMHWJMY-UHFFFAOYSA-N
Mol Weight 462.34 g/mol
Molecular Formula C21H21Cl2N5O3
Exact Mass 461.102145 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 6MzyVqNgqkX
Name benzoic acid, 4-[5-[(2,4-dichlorophenyl)-4-morpholinylmethyl]-1H-tetrazol-1-yl]-, ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 461.102144953 u
Formula C21H21Cl2N5O3
InChI InChI=1S/C21H21Cl2N5O3/c1-2-31-21(29)14-3-6-16(7-4-14)28-20(24-25-26-28)19(27-9-11-30-12-10-27)17-8-5-15(22)13-18(17)23/h3-8,13,19H,2,9-12H2,1H3
InChIKey WPHALTHRMHWJMY-UHFFFAOYSA-N
Molecular Weight 462.337 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8804
Solvent DMSO-d6
Source Vendor ID: NMR/10230825; Lab Info: NP; Lab Number: NP-TP00070
Temperature 29.85 °C