SpectraBase Spectrum ID |
1J11hqlKeDw |
Name |
(-)-(4R,5R)-Methyl dihydroabscisate |
CAS Registry Number |
130694-68-7 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H24O4 |
InChI |
InChI=1S/C16H24O4/c1-11(8-14(18)20-5)6-7-16(19)12(2)9-13(17)10-15(16,3)4/h6-8,12,19H,9-10H2,1-5H3/b7-6+,11-8-/t12-,16+/m1/s1 |
InChIKey |
XMDUFQUWUYHKRS-PCIKFFTASA-N |
Molecular Weight |
280.364 g/mol |
SMILES |
O[C@@]1(C(CC(C[C@]1(C)[H])=O)(C)C)\C=C\C(=C/C(=O)OC)C |
SPLASH |
splash10-00di-0900000000-351c7d5e32d32c369ba5 |
Source of Spectrum |
I-68-1159-24 |
Synonyms |
Methyl (2Z,4E)-5-[(1R,6R)-1-hydroxy-2,2,6-trimethyl-4-oxocyclohexyl]-3-methyl-2,4-pentadienoate |
Wiley ID |
1283984 |