| SpectraBase Spectrum ID |
KIxNaFpQOvI |
| Name |
benzoic acid, 3,4-dichloro-, 4-(6-amino-5-cyano-1,4-dihydro-3-methylpyrano[2,3-c]pyrazol-4-yl)phenyl 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 |
440.044295724 u |
| Formula |
C21H14Cl2N4O3 |
| InChI |
InChI=1S/C21H14Cl2N4O3/c1-10-17-18(14(9-24)19(25)30-20(17)27-26-10)11-2-5-13(6-3-11)29-21(28)12-4-7-15(22)16(23)8-12/h2-8,18H,25H2,1H3,(H,26,27) |
| InChIKey |
IUCGHGGDIGZZRX-UHFFFAOYSA-N |
| Molecular Weight |
441.274 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7592 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9313575; Lab Info: VUR; Lab Number: VUR-0000910 |
![3,4-Dichloro-benzoic acid 4-(6-amino-5-cyano-3-methyl-1,4-dihydro-pyrano[2,3-c]pyrazol-4-yl)-phenyl ester](/api/spectrum/KIxNaFpQOvI/structure.png?h=300&w=458 "3,4-Dichloro-benzoic acid 4-(6-amino-5-cyano-3-methyl-1,4-dihydro-pyrano[2,3-c]pyrazol-4-yl)-phenyl ester")
