| SpectraBase Spectrum ID |
24U0PufoCuE |
| Name |
dimethyl 1-propenyl-2,5-dihydrobenzene-3,4-dicarboxylate |
| Alternate Name(s) |
dimethyl 4-[(1E)-1-propenyl]-1,4-cyclohexadiene-1,2-dicarboxylate |
| CAS Registry Number |
108200-76-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16O4 |
| InChI |
InChI=1S/C13H16O4/c1-4-5-9-6-7-10(12(14)16-2)11(8-9)13(15)17-3/h4-6H,7-8H2,1-3H3/b5-4+ |
| InChIKey |
LIBGBAGFCSBZQL-SNAWJCMRSA-N |
| Molecular Weight |
236.267 g/mol |
| SMILES |
C1(=C(C(=O)OC)CC=C(C1)\C=C\C)C(=O)OC |
| SPLASH |
splash10-0udi-0090000000-00c4535ea42fc5a2bd30 |
| Source of Spectrum |
AJ-59-1872-15 |
| Wiley ID |
1238106 |
