| SpectraBase Spectrum ID |
289ToeA9Qon |
| Name |
2-benzyl-2-chloro-malonic acid dimethyl ester |
| Alternate Name(s) |
2-chloro-2-(phenylmethyl)propanedioic acid dimethyl ester
dimethyl 2-benzyl-2-chloro-propanedioate
dimethyl 2-chloranyl-2-(phenylmethyl)propanedioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13ClO4 |
| InChI |
InChI=1S/C12H13ClO4/c1-16-10(14)12(13,11(15)17-2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3 |
| InChIKey |
SPQWYSQMMJDLGH-UHFFFAOYSA-N |
| Molecular Weight |
256.685 g/mol |
| SMILES |
C(C(=O)OC)(C(=O)OC)(Cc1ccccc1)Cl |
| SPLASH |
splash10-052r-0940000000-6fa41e48b89af387ee71 |
| Source of Spectrum |
J-58-4598-3 |
| Wiley ID |
1259378 |
