SpectraBase Spectrum ID |
7BHZ48Y3CZk |
Name |
benzo[b]thiophene-3-carboxylic acid, 2-[[[5-[(4-ethylphenoxy)methyl]-2-furanyl]carbonyl]amino]-4,5,6,7-tetrahydro-6-methyl-, |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
467.176644207 u |
Formula |
C26H29NO5S |
InChI |
InChI=1S/C26H29NO5S/c1-4-17-7-9-18(10-8-17)31-15-19-11-13-21(32-19)24(28)27-25-23(26(29)30-5-2)20-12-6-16(3)14-22(20)33-25/h7-11,13,16H,4-6,12,14-15H2,1-3H3,(H,27,28) |
InChIKey |
KYBQTWXBXOSEPQ-UHFFFAOYSA-N |
Molecular Weight |
467.580 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_1288 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13248019 |