| SpectraBase Spectrum ID |
D02e1w6RkZ1 |
| Name |
benzoic acid, 4-(3-acetyl-6-amino-5-cyano-2-methyl-4H-pyran-4-yl)-,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 |
312.111006999 u |
| Formula |
C17H16N2O4 |
| InChI |
InChI=1S/C17H16N2O4/c1-9(20)14-10(2)23-16(19)13(8-18)15(14)11-4-6-12(7-5-11)17(21)22-3/h4-7,15H,19H2,1-3H3 |
| InChIKey |
GFJVUMKWIRMLBY-UHFFFAOYSA-N |
| Molecular Weight |
312.325 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7140 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10220878; Lab Info: VUR; Lab Number: VUR-0000988 |
| Temperature |
29.85 °C |
