SpectraBase Spectrum ID |
F39su0uj63r |
Name |
4-{4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzoyl}thiomorpholine |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
346.109961627 u |
Formula |
C16H18N4O3S |
InChI |
InChI=1S/C16H18N4O3S/c1-12-10-15(20(22)23)17-19(12)11-13-2-4-14(5-3-13)16(21)18-6-8-24-9-7-18/h2-5,10H,6-9,11H2,1H3 |
InChIKey |
LYIFCYVXGURWLU-UHFFFAOYSA-N |
Molecular Weight |
346.405 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_9119 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13228363 |