| SpectraBase Spectrum ID |
JWvYrwibrUd |
| Name |
2-(1-methyl-3-oxo-1-isobenzofuranyl)propanedioic acid diethyl ester |
| Alternate Name(s) |
2-(3-keto-1-methyl-phthalan-1-yl)malonic acid diethyl ester
diethyl 2-(1-methyl-3-oxidanylidene-2-benzofuran-1-yl)propanedioate
diethyl 2-(1-methyl-3-oxo-2-benzofuran-1-yl)propanedioate
diethyl 2-(1-methyl-3-oxo-isobenzofuran-1-yl)propanedioate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O6 |
| InChI |
InChI=1S/C16H18O6/c1-4-20-14(18)12(15(19)21-5-2)16(3)11-9-7-6-8-10(11)13(17)22-16/h6-9,12H,4-5H2,1-3H3 |
| InChIKey |
YUIKMXCTJHJGOO-UHFFFAOYSA-N |
| Molecular Weight |
306.314 g/mol |
| SMILES |
C1(OC(=O)c2c1cccc2)(C(C(=O)OCC)C(=O)OCC)C |
| SPLASH |
splash10-0002-0901000000-ba9f4fc8d9a2104f030b |
| Source of Spectrum |
MZ-34-1188-11 |
| Wiley ID |
1582135 |
