| SpectraBase Spectrum ID |
4iKALiOhTzq |
| Name |
Butanedioic-1-13C acid, 2-methyl-3-oxo-, diethyl ester |
| Alternate Name(s) |
2-Methyl-3-oxobutanedioic-1-C(13) acid diethyl ester
Diethyl 2-methyl-3-oxo-[1-C(13)]-butanedioate |
| CAS Registry Number |
126615-15-4 |
| Comments |
Original formula: C8[13C]H14O5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H14O5 |
| InChI |
InChI=1S/C9H14O5/c1-4-13-8(11)6(3)7(10)9(12)14-5-2/h6H,4-5H2,1-3H3/i8+1 |
| InChIKey |
OQOCQBJWOCRPQY-VJJZLTLGSA-N |
| Molecular Weight |
203.198 g/mol |
| SMILES |
C([13C](=O)OCC)(C(C(=O)OCC)=O)C |
| SPLASH |
splash10-001i-4900000000-1b22ab45c87c3fa59d68 |
| Source of Spectrum |
Y-27-1860-4 |
| Wiley ID |
1197345 |
