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Abscisic acid
SpectraBase Compound ID H6jdEy8CfEb
InChI InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1
InChIKey JLIDBLDQVAYHNE-YKALOCIXSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 77PZiImEuGa
Name Abscisic acid
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 21293-29-8
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1
InChIKey JLIDBLDQVAYHNE-YKALOCIXSA-N
Melting Point 186-188C
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ABSCISIC ACID, /plus,minus/-, 2,4-PENTADIENOIC ACID, 5-/1-HYDROXY- 4-OXO-2,6,6-TRIMETHYL-2-CYCLOHEXEN- 1-YL/-3-METHYL-, cis-2-,trans-4-,