SpectraBase Spectrum ID |
K1OragaiOlV |
Name |
3-thiophenecarboxylic acid, 2-[[2-(2-bromophenoxy)-1-oxopropyl]amino]-4,5-dimethyl-, ethyl 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 |
425.029642298 u |
Formula |
C18H20BrNO4S |
InChI |
InChI=1S/C18H20BrNO4S/c1-5-23-18(22)15-10(2)12(4)25-17(15)20-16(21)11(3)24-14-9-7-6-8-13(14)19/h6-9,11H,5H2,1-4H3,(H,20,21) |
InChIKey |
VGBAESYZGWCPOJ-UHFFFAOYSA-N |
Molecular Weight |
426.325 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_12527 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10021560; Lab Info: PNA; Lab Number: PNA-1990980 |