| SpectraBase Spectrum ID |
H0HuxkK5YXX |
| Name |
Methyl 4-(2-amino-3-cyano-5,6,7,8-tetrahydro-7,7-dimethyl-5-oxo-4H-chromen-4-yl)benzoate |
| Appearance |
White powder |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H20N2O4 |
| InChI |
InChI=1S/C20H20N2O4/c1-20(2)8-14(23)17-15(9-20)26-18(22)13(10-21)16(17)11-4-6-12(7-5-11)19(24)25-3/h4-7,16H,8-9,22H2,1-3H3 |
| InChIKey |
UBVCXYTVNQJOJJ-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu QP 1100EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.arabjc.2013.07.055 |
| Molecular Weight |
352.390 g/mol |
| SMILES |
NC1=C(C(c2ccc(C(OC)=O)cc2)C2=C(O1)CC(CC2=O)(C)C)C#N |
| SPLASH |
splash10-00yi-8791000000-33bcfff96018af1b18c2 |
| Source of Spectrum |
AJC-10-S2214-4k |
| Wiley ID |
1857176 |
