| SpectraBase Spectrum ID |
HMWvcAq2gH7 |
| Name |
2-[acetamido-(4-cyanophenyl)methyl]-3-keto-butyric acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H16N2O4 |
| InChI |
InChI=1S/C15H16N2O4/c1-9(18)13(15(20)21-3)14(17-10(2)19)12-6-4-11(8-16)5-7-12/h4-7,13-14H,1-3H3,(H,17,19) |
| InChIKey |
UWKCIUHJWFNBSB-UHFFFAOYSA-N |
| Molecular Weight |
288.303 g/mol |
| SMILES |
N(C(C(C(=O)OC)C(=O)C)c1ccc(cc1)C#N)C(C)=O |
| SPLASH |
splash10-0079-0790000000-6b97f54e347bc6eb4c85 |
| Source of Spectrum |
F-68-4082-2 |
| Synonyms |
2-[acetamido-(4-cyanophenyl)methyl]-3-oxobutanoic acid methyl ester
methyl 2-[acetamido-(4-cyanophenyl)methyl]-3-oxidanylidene-butanoate
methyl 2-[acetamido-(4-cyanophenyl)methyl]-3-oxo-butanoate |
| Wiley ID |
1572501 |
![2-[acetamido-(4-cyanophenyl)methyl]-3-keto-butyric acid methyl ester](/api/spectrum/HMWvcAq2gH7/structure.png?h=300&w=458 "2-[acetamido-(4-cyanophenyl)methyl]-3-keto-butyric acid methyl ester")
