SpectraBase Spectrum ID |
LMp29f5MkZS |
Name |
1H-pyrido[4,3-b]indole, 5-[[[1-(2-fluorophenyl)-1H-tetrazol-5-yl]thio]acetyl]-2,3,4,4a,5,9b-hexahydro-2,8-dimethyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
438.163808721 u |
Formula |
C22H23FN6OS |
InChI |
InChI=1S/C22H23FN6OS/c1-14-7-8-18-15(11-14)16-12-27(2)10-9-19(16)28(18)21(30)13-31-22-24-25-26-29(22)20-6-4-3-5-17(20)23/h3-8,11,16,19H,9-10,12-13H2,1-2H3 |
InChIKey |
WTMJMTUMNVSBTJ-UHFFFAOYSA-N |
Molecular Weight |
438.525 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5022 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/9068666; Lab Info: SAD; Lab Number: SAD-EXCO029 |