SpectraBase Spectrum ID |
98BLhCnim81 |
Name |
4H-1,2,4-triazole, 3-[(1,3-benzodioxol-5-ylmethyl)thio]-4-methyl-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 |
325.088497907 u |
Formula |
C17H15N3O2S |
InChI |
InChI=1S/C17H15N3O2S/c1-20-16(13-5-3-2-4-6-13)18-19-17(20)23-10-12-7-8-14-15(9-12)22-11-21-14/h2-9H,10-11H2,1H3 |
InChIKey |
GNRDOSDAWZCYSK-UHFFFAOYSA-N |
Molecular Weight |
325.386 g/mol |
NMR Offset |
15.0036 |
NMR Spectrometer Frequency |
250.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_566 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/8021628; Lab Info: LP; Lab Number: LP-0802131 |
Temperature |
23.85 °C |