SpectraBase Spectrum ID |
C3ceDHdH2Nt |
Name |
benzoic acid, 4-[5-[[(2-fluorophenyl)methyl]thio]-1H-tetrazol-1-yl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
330.058674945 u |
Formula |
C15H11FN4O2S |
InChI |
InChI=1S/C15H11FN4O2S/c16-13-4-2-1-3-11(13)9-23-15-17-18-19-20(15)12-7-5-10(6-8-12)14(21)22/h1-8H,9H2,(H,21,22) |
InChIKey |
ZTKZQYVWQKJBKX-UHFFFAOYSA-N |
Molecular Weight |
330.337 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_1846 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/8316744; Lab Info: LP; Lab Number: LP-3700551 |
Temperature |
29.85 °C |