| SpectraBase Spectrum ID |
DDf1xpUR2Zw |
| Name |
Methyl N-[1-(Methylthio)-2-nitroethenyl]-L-phenylalaninate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16N2O4S |
| InChI |
InChI=1S/C13H16N2O4S/c1-19-13(16)11(8-10-6-4-3-5-7-10)14-12(20-2)9-15(17)18/h3-7,9,11,14H,8H2,1-2H3/b12-9-/t11-/m0/s1 |
| InChIKey |
CYJDKIIQYFMXCR-AWPPVZKDSA-N |
| Molecular Weight |
296.341 g/mol |
| SMILES |
N(\C(=C\N(=O)=O)SC)[C@](C(=O)OC)(Cc1ccccc1)[H] |
| SPLASH |
splash10-0006-9010000000-4dc0e7ce015ebf7d7fb1 |
| Source of Spectrum |
F-49-2107-8 |
| Synonyms |
methyl (2S)-2-{[(Z)-1-(methylsulfanyl)-2-nitroethenyl]amino}-3-phenylpropanoate |
| Wiley ID |
1298708 |
![Methyl N-[1-(Methylthio)-2-nitroethenyl]-L-phenylalaninate](/api/spectrum/DDf1xpUR2Zw/structure.png?h=300&w=458 "Methyl N-[1-(Methylthio)-2-nitroethenyl]-L-phenylalaninate")
