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 |