SpectraBase Spectrum ID |
Jfkpq13buPv |
Name |
benzoic acid, 3-[5-[(Z)-(3-oxobenzo[b]thien-2(3H)-ylidene)methyl]-2-furanyl]-, methyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
362.061280101 u |
Formula |
C21H14O4S |
InChI |
InChI=1S/C21H14O4S/c1-24-21(23)14-6-4-5-13(11-14)17-10-9-15(25-17)12-19-20(22)16-7-2-3-8-18(16)26-19/h2-12H,1H3/b19-12- |
InChIKey |
XOXUDDMFGQEKSP-UNOMPAQXSA-N |
Molecular Weight |
362.399 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15109 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10311104; Lab Info: SAD; Lab Number: SAD-002593 |