![(E)-3-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-propenoic acid methyl ester](/api/spectrum/HQ67PBojltO/structure.png?h=300&w=458 "(E)-3-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-propenoic acid methyl ester")
| SpectraBase Compound ID | 46aM7mVzl3g |
|---|---|
| InChI | InChI=1S/C10H16O4/c1-7-8(5-6-9(11)12-4)14-10(2,3)13-7/h5-8H,1-4H3/b6-5+/t7-,8+/m1/s1 |
| InChIKey | LWELGTICSFZEDV-KTERXBQFSA-N |
| Mol Weight | 200.23 g/mol |
| Molecular Formula | C10H16O4 |
| Exact Mass | 200.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HQ67PBojltO |
|---|---|
| Name | (E)-3-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-propenoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H16O4 |
| InChI | InChI=1S/C10H16O4/c1-7-8(5-6-9(11)12-4)14-10(2,3)13-7/h5-8H,1-4H3/b6-5+/t7-,8+/m1/s1 |
| InChIKey | LWELGTICSFZEDV-KTERXBQFSA-N |
| Molecular Weight | 200.234 g/mol |
| SMILES | C1(O[C@@](\C=C\C(=O)OC)([C@](O1)(C)[H])[H])(C)C |
| SPLASH | splash10-0007-9400000000-8b4e52c1d75126f7b876 |
| Source of Spectrum | J-58-1527-13 |
| Synonyms | Methyl trans-4,5-(isopropylidenedioxy)-2(Z)-hexenoate (E)-3-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]acrylic acid methyl ester (E)-3-((4S,5R)-2,2,5-Trimethyl-[1,3]dioxolan-4-yl)-acrylic acid methyl ester Methyl (E)-3-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]prop-2-enoate Methyl (2Z)-3-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-propenoate Methyl trans-4,5-(isopropylidenedioxy)-2(E)-hexenoate (E)-3-[(4S,5R)-2,2,5-trimethyl-1,3-dioxolan-4-yl]-2-propenoic acid methyl ester Methyl (E)-3-[(4S,5R)-2,2,5-trimethyl-1,3-dioxolan-4-yl]prop-2-enoate |
| Wiley ID | 1197494 |