| SpectraBase Spectrum ID |
LvgNBErmMkM |
| Name |
18-O-(carboxyl)-Methyl abscisate |
| Alternate Name(s) |
Methyl(1-18O)abscisate
Methyl 5-[2',2',6'-trimethyl-4'-oxo-cyclohex-5'-enyl)-3-methylpent-2-enoate-(18-O-carboxyl) |
| Comments |
Original formula: C16H22O3[18O] |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H22O4 |
| InChI |
InChI=1S/C16H22O4/c1-11(8-14(18)20-5)6-7-16(19)12(2)9-13(17)10-15(16,3)4/h6-9,19H,10H2,1-5H3/b7-6+,11-8-/i18+2 |
| InChIKey |
HHDYPZVHXGPCRG-NKBBJAIFSA-N |
| Molecular Weight |
280.348 g/mol |
| SMILES |
OC1(C(=CC(CC1(C)C)=O)C)\C=C\C(=C/C(=[18O])OC)C |
| SPLASH |
splash10-03fs-0090000000-f4ac0766444c24722f9b |
| Source of Spectrum |
O-34-617-0 |
| Wiley ID |
763384 |
