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(-)-(4S,5R)-Dihydroabscisic acid
SpectraBase Compound ID 7mkJSJqWhNU
InChI InChI=1S/C15H22O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-7,11,19H,8-9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t11-,15-/m1/s1
InChIKey LPYBIZVNSMWXPK-OORBCYPVSA-N
Mol Weight 266.34 g/mol
Molecular Formula C15H22O4
Exact Mass 266.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uLHx2ircnm
Name (-)-(4S,5R)-Dihydroabscisic acid
Alternate Name(s) (2Z,4E)-5-[(1S,6R)-1-hydroxy-2,2,6-trimethyl-4-oxocyclohexyl]-3-methyl-2,4-pentadienoic acid
CAS Registry Number 130696-65-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O4
InChI InChI=1S/C15H22O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-7,11,19H,8-9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t11-,15-/m1/s1
InChIKey LPYBIZVNSMWXPK-OORBCYPVSA-N
Molecular Weight 266.337 g/mol
SMILES OC(\C=C/(\C=C\[C@@]1(C(CC(C[C@]1(C)[H])=O)(C)C)O)C)=O
SPLASH splash10-0229-0900000000-e23c94c16ff29e7a9379
Source of Spectrum I-68-1160-5
Wiley ID 1270100