| SpectraBase Spectrum ID |
G5vPX1CCElX |
| Name |
2-Butenoic acid, 2-[(acetyloxy)methyl]-, 5-acetyl-2,3-dihydro-6-hydroxy-2-(1-methylethenyl)-3-benzofuranyl ester, [2S-[2.alpha.,3.beta.(Z)]]- |
| Alternate Name(s) |
(2S,3R)-5-acetyl-6-hydroxy-2-isopropenyl-2,3-dihydro-1-benzofuran-3-yl (2Z)-2-[(acetyloxy)methyl]-2-butenoate
.alpha.-acetoxymethyl-trans-crotonate
trans-3-hydroxy-2,3-dihydroeuparin |
| CAS Registry Number |
62868-68-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H22O7 |
| InChI |
InChI=1S/C20H22O7/c1-6-13(9-25-12(5)22)20(24)27-19-15-7-14(11(4)21)16(23)8-17(15)26-18(19)10(2)3/h6-8,18-19,23H,2,9H2,1,3-5H3/b13-6-/t18-,19+/m0/s1 |
| InChIKey |
QDMKPJRHOAHMJH-RYMMQFKXSA-N |
| Molecular Weight |
374.389 g/mol |
| SMILES |
Oc1c(cc2[C@]([C@](C(=C)C)(Oc2c1)[H])(OC(\C(COC(=O)C)=C/C)=O)[H])C(=O)C |
| SPLASH |
splash10-0gb9-0290000000-4e234ce58d586aca6e55 |
| Source of Spectrum |
K-110-1039-0 |
| Wiley ID |
1356584 |
![2-Butenoic acid, 2-[(acetyloxy)methyl]-, 5-acetyl-2,3-dihydro-6-hydroxy-2-(1-methylethenyl)-3-benzofuranyl ester, [2S-[2.alpha.,3.beta.(Z)]]-](/api/spectrum/G5vPX1CCElX/structure.png?h=300&w=458 "2-Butenoic acid, 2-[(acetyloxy)methyl]-, 5-acetyl-2,3-dihydro-6-hydroxy-2-(1-methylethenyl)-3-benzofuranyl ester, [2S-[2.alpha.,3.beta.(Z)]]-")
