SpectraBase Spectrum ID |
A0QOyo7rxAx |
Name |
2-propenoic acid, 2-cyano-3-[5-(2,5-dichlorophenyl)-2-furanyl]-, octylester, (2E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
419.105499002 u |
Formula |
C22H23Cl2NO3 |
InChI |
InChI=1S/C22H23Cl2NO3/c1-2-3-4-5-6-7-12-27-22(26)16(15-25)13-18-9-11-21(28-18)19-14-17(23)8-10-20(19)24/h8-11,13-14H,2-7,12H2,1H3/b16-13+ |
InChIKey |
BRTCDNQGDKKWLC-DTQAZKPQSA-N |
Molecular Weight |
420.336 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6933 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9321355; Lab Info: OBU; Lab Number: OBU-0004532 |
Temperature |
23.85 °C |