SpectraBase Spectrum ID |
ALVCnpEvzNb |
Name |
3H-pyrazol-3-one, 2-(2-benzothiazolyl)-1,2-dihydro-4-[(1Z)-1-[[(Z)-2-hydroxyethyl]imino]ethyl]-5-phenyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
378.115047008 u |
Formula |
C20H18N4O2S |
InChI |
InChI=1S/C20H18N4O2S/c1-13(21-11-12-25)17-18(14-7-3-2-4-8-14)23-24(19(17)26)20-22-15-9-5-6-10-16(15)27-20/h2-10,23,25H,11-12H2,1H3/b21-13- |
InChIKey |
YTFXOQZTBUFMHP-BKUYFWCQSA-N |
Molecular Weight |
378.450 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11957 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10260080; Lab Info: PRE; Lab Number: PRE-vgy12000 |