| SpectraBase Spectrum ID |
GxOEn0oH5zZ |
| Name |
[(1S)-1-(5,8-dihydroxy-1,4-dioxo-2-naphthyl)-4-methyl-pent-3-enyl] 3-methylbut-2-enoate |
| Appearance |
Fuchsia solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O6 |
| InChI |
InChI=1S/C21H22O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,9-10,17,22-23H,8H2,1-4H3/t17-/m0/s1 |
| InChIKey |
BATBOVZTQBLKIL-KRWDZBQOSA-N |
| Instrument Name |
Agilent 5973N MSD |
| Ionization Type |
EI |
| Molecular Weight |
370.401 g/mol |
| Optical Rotation |
[a]D22.7 = -143 (c = 0.01, acetone) |
| SMILES |
Oc1ccc(c2c1C(C(=CC2=O)[C@](CC=C(C)C)(OC(C=C(C)C)=O)[H])=O)O |
| SPLASH |
splash10-00di-0090000000-bbb0efea25d792f02e5f |
| Source of Spectrum |
CN101597230B |
| Wiley ID |
1846972 |
