| SpectraBase Spectrum ID |
2PrPBGiFpj4 |
| Name |
1-d3-Methyl 4-methyl citraconate |
| CAS Registry Number |
617-54-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H7D3O4 |
| InChI |
InChI=1S/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h4H,1-3H3/b5-4-/i3D3 |
| InChIKey |
WQEXBUQDXKPVHR-IUIPJHRYSA-N |
| Molecular Weight |
161.171 g/mol |
| SMILES |
C(OC([D])([D])[D])(\C(=C/C(=O)OC)C)=O |
| SPLASH |
splash10-004i-0900000000-79deac5d16d1e889e7cc |
| Source of Spectrum |
O-21-227-1e |
| Synonyms |
2-Butenedioic acid, 2-methyl-, (d3)-dimethyl ester, (Z)-
(d3)-Dimethyl citraconate |
| Wiley ID |
1155052 |
