SpectraBase Spectrum ID |
84Uy2ChP6Hb |
Name |
4-thiazolidinecarboxylic acid, 2-[3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
425.040875687 u |
Formula |
C17H20BrN3O3S |
InChI |
InChI=1S/C17H20BrN3O3S/c1-9-15(18)10(2)21(20-9)7-12-6-11(4-5-14(12)24-3)16-19-13(8-25-16)17(22)23/h4-6,13,16,19H,7-8H2,1-3H3,(H,22,23) |
InChIKey |
KMIJZKKRDNQFTK-UHFFFAOYSA-N |
Molecular Weight |
426.329 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14555 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10310658; Lab Info: PNA; Lab Number: PNA-NA00174 |