SpectraBase Spectrum ID |
8Dax8FhxjMJ |
Name |
tricyclo[3.3.1.1~3,7~]decane-1-carboxamide, N-[3-[[2-[(1-phenyl-1H-tetrazol-5-yl)thio]acetyl]amino]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 |
488.199445338 u |
Formula |
C26H28N6O2S |
InChI |
InChI=1S/C26H28N6O2S/c33-23(16-35-25-29-30-31-32(25)22-7-2-1-3-8-22)27-20-5-4-6-21(12-20)28-24(34)26-13-17-9-18(14-26)11-19(10-17)15-26/h1-8,12,17-19H,9-11,13-16H2,(H,27,33)(H,28,34)/t17-,18+,19-,26- |
InChIKey |
BIAFLOPRZGVOMZ-MCTDJQMZSA-N |
Molecular Weight |
488.610 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14291 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10322313; Lab Info: KTS; Lab Number: KTS-0000837 |