| SpectraBase Spectrum ID |
60ahesRhHNH |
| Name |
[ring-2H5,1,2-13C2]-3-Oxo-3-phenylpropionic acid ethyl ester |
| Comments |
Original formula: C9[13C]2H7D5O3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12O3 |
| InChI |
InChI=1S/C11H12O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3/i3D,4D,5D,6D,7D,8+1,11+1 |
| InChIKey |
GKKZMYDNDDMXSE-TVKCGURASA-N |
| Molecular Weight |
199.229 g/mol |
| SMILES |
[13CH2]([13C](=O)OCC)C(=O)c1c(c([2D])c(c(c1[2D])[2D])[2D])[2D] |
| SPLASH |
splash10-0ika-6920000000-eeb89d8a365640910ce4 |
| Source of Spectrum |
F-56-9119-10 |
| Wiley ID |
859220 |
![[ring-2H5,1,2-13C2]-3-Oxo-3-phenylpropionic acid ethyl ester](/api/spectrum/60ahesRhHNH/structure.png?h=300&w=458 "[ring-2H5,1,2-13C2]-3-Oxo-3-phenylpropionic acid ethyl ester")
