| SpectraBase Spectrum ID |
5H5YjjCzDFp |
| Name |
4H-pyran-2-acetic acid, 6-amino-5-cyano-3-(ethoxycarbonyl)-4-(2,4,5-trimethoxyphenyl)-, 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 |
446.168915797 u |
| Formula |
C22H26N2O8 |
| InChI |
InChI=1S/C22H26N2O8/c1-6-30-18(25)10-17-20(22(26)31-7-2)19(13(11-23)21(24)32-17)12-8-15(28-4)16(29-5)9-14(12)27-3/h8-9,19H,6-7,10,24H2,1-5H3 |
| InChIKey |
IOXJACJFBTUQPH-UHFFFAOYSA-N |
| Molecular Weight |
446.456 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_2131 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13268331 |
