SpectraBase Spectrum ID |
K1MZ2GgyB48 |
Name |
2,4-thiophenedicarboxylic acid, 3-methyl-5-[[(2-phenylcyclopropyl)carbonyl]amino]-, diethyl 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 |
401.129694014 u |
Formula |
C21H23NO5S |
InChI |
InChI=1S/C21H23NO5S/c1-4-26-20(24)16-12(3)17(21(25)27-5-2)28-19(16)22-18(23)15-11-14(15)13-9-7-6-8-10-13/h6-10,14-15H,4-5,11H2,1-3H3,(H,22,23) |
InChIKey |
YYFRFBQEOYUNDM-UHFFFAOYSA-N |
Molecular Weight |
401.477 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_13996 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10021092; Lab Info: PNA; Lab Number: PNA-1991553 |