SpectraBase Spectrum ID |
BVKMbvKyEx2 |
Name |
benzoic acid, 4-chloro-2-[[3-(dimethylamino)propyl]amino]-5-(1-piperidinylsulfonyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
403.133255199 u |
Formula |
C17H26ClN3O4S |
InChI |
InChI=1S/C17H26ClN3O4S/c1-20(2)8-6-7-19-15-12-14(18)16(11-13(15)17(22)23)26(24,25)21-9-4-3-5-10-21/h11-12,19H,3-10H2,1-2H3,(H,22,23) |
InChIKey |
MRLCMERBNASOFI-UHFFFAOYSA-N |
Molecular Weight |
403.925 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_1237 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13239910 |