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5-METHYL-4-HYDROXY-2-OXO-3-HEXENE
SpectraBase Compound ID GrRxIzo3bbS
InChI InChI=1S/C7H12O2/c1-5(2)7(9)4-6(3)8/h4-5,9H,1-3H3/b7-4-
InChIKey UTTSDKCNJMWXSK-DAXSKMNVSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9aWOiyZnwh
Name 5-Methylhexane-2,4-dione, enol
Alternate Name(s) (3Z)-4-Hydroxy-5-methyl-3-hexen-2-one (Z)-4-hydroxy-5-methylhex-3-en-2-one
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-5(2)7(9)4-6(3)8/h4-5,9H,1-3H3/b7-4-
InChIKey UTTSDKCNJMWXSK-DAXSKMNVSA-N
Molecular Weight 128.171 g/mol
SMILES O\C(C(C)C)=C/C(=O)C
SPLASH splash10-002u-9100000000-d5511e95b57476eeda68
Wiley ID 1476907