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(2E)-2-[(E)-but-2-enylidene]pentane-1,3,4-triol

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(2E)-2-[(E)-but-2-enylidene]pentane-1,3,4-triol
SpectraBase Compound ID 6vvSBn9j4o
InChI InChI=1S/C9H16O3/c1-3-4-5-8(6-10)9(12)7(2)11/h3-5,7,9-12H,6H2,1-2H3/b4-3+,8-5+
InChIKey RRFNHQIEVWBAEI-SALQQRKASA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24ZKAjhkbTQ
Name (2E)-2-[(E)-but-2-enylidene]pentane-1,3,4-triol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-4-5-8(6-10)9(12)7(2)11/h3-5,7,9-12H,6H2,1-2H3/b4-3+,8-5+
InChIKey RRFNHQIEVWBAEI-SALQQRKASA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 172.224 g/mol
Source File Reference MHKO17526