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benzoic acid, 4-[5-[(2-chlorophenyl)-4-morpholinylmethyl]-1H-tetrazol-1-yl]-, ethyl ester
SpectraBase Compound ID CKmcMWUjGGq
InChI InChI=1S/C21H22ClN5O3/c1-2-30-21(28)15-7-9-16(10-8-15)27-20(23-24-25-27)19(26-11-13-29-14-12-26)17-5-3-4-6-18(17)22/h3-10,19H,2,11-14H2,1H3
InChIKey OTOFEJCTKSBMES-UHFFFAOYSA-N
Mol Weight 427.89 g/mol
Molecular Formula C21H22ClN5O3
Exact Mass 427.141117 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1xnqo1QspeL
Name benzoic acid, 4-[5-[(2-chlorophenyl)-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 427.141117285 u
Formula C21H22ClN5O3
InChI InChI=1S/C21H22ClN5O3/c1-2-30-21(28)15-7-9-16(10-8-15)27-20(23-24-25-27)19(26-11-13-29-14-12-26)17-5-3-4-6-18(17)22/h3-10,19H,2,11-14H2,1H3
InChIKey OTOFEJCTKSBMES-UHFFFAOYSA-N
Molecular Weight 427.892 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4221
Solvent DMSO-d6
Source Vendor ID: NMR/9223612; Lab Info: NP; Lab Number: NP-TP02099