SpectraBase Spectrum ID |
KihSYmFANhB |
Name |
3H-1,2,4-triazole-3-thione, 5-(2-chlorophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-2,4-dihydro-4-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 |
442.123024869 u |
Formula |
C22H23ClN4O2S |
InChI |
InChI=1S/C22H23ClN4O2S/c23-19-9-5-4-8-18(19)20-24-26(21(30)27(20)17-6-2-1-3-7-17)16-25-12-10-22(11-13-25)28-14-15-29-22/h1-9H,10-16H2 |
InChIKey |
GFQYKOWVEJCBAK-UHFFFAOYSA-N |
Molecular Weight |
442.965 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_7185 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10222344; Lab Info: LP; Lab Number: LP-2100161 |