| SpectraBase Spectrum ID |
Jz0bkyJAWNh |
| Name |
1,4-Cyclohexadiene-1,2-dicarboxylic acid, 5-ethenyl-3-methyl-, dimethyl ester |
| Alternate Name(s) |
Dimethyl 1-methyl-3-ethenyl-1,4-dihydrobenzene-5,6-dicarboxylate
dimethyl 3-methyl-5-vinyl-1,4-cyclohexadiene-1,2-dicarboxylate |
| CAS Registry Number |
108200-75-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O4 |
| InChI |
InChI=1S/C13H16O4/c1-5-9-6-8(2)11(13(15)17-4)10(7-9)12(14)16-3/h5-6,8H,1,7H2,2-4H3 |
| InChIKey |
BMCNTDCTLXWVRK-UHFFFAOYSA-N |
| Molecular Weight |
236.267 g/mol |
| SMILES |
C1(=C(C(C)C=C(C1)C=C)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-066r-0950000000-80abb114ecd1b92406c9 |
| Source of Spectrum |
AJ-59-1872-14 |
| Wiley ID |
1238107 |
