| SpectraBase Spectrum ID |
BugNF90WRcx |
| Name |
1-tert-butyl-3-methyl-4-(phenylsulfonyl)-1H-pyrazol-5-yl 3-cyclopentylpropanoate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.192628624 u |
| Formula |
C22H30N2O4S |
| InChI |
InChI=1S/C22H30N2O4S/c1-16-20(29(26,27)18-12-6-5-7-13-18)21(24(23-16)22(2,3)4)28-19(25)15-14-17-10-8-9-11-17/h5-7,12-13,17H,8-11,14-15H2,1-4H3 |
| InChIKey |
QBQXEIHQFDENFG-UHFFFAOYSA-N |
| Molecular Weight |
418.552 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_8661 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13219953 |
