| SpectraBase Spectrum ID |
41NVTZhD5jG |
| Name |
4H-pyran-3-carboxylic acid, 6-amino-4-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-cyano-2-propyl-, 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 |
426.145868314 u |
| Formula |
C22H23ClN4O3 |
| InChI |
InChI=1S/C22H23ClN4O3/c1-4-9-16-19(22(28)29-5-2)18(15(12-24)21(25)30-16)17-13(3)26-27(20(17)23)14-10-7-6-8-11-14/h6-8,10-11,18H,4-5,9,25H2,1-3H3 |
| InChIKey |
JOMPOPOEVBEWNN-UHFFFAOYSA-N |
| Molecular Weight |
426.904 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2307 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8164879; Lab Info: TSH; Lab Number: TSH-f000643 |
| Temperature |
29.85 °C |
