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3-Penten-2-one, 4-(acetyloxy)-3-methyl-, (Z)-
SpectraBase Compound ID 3Tn3if68mQH
InChI InChI=1S/C8H12O3/c1-5(6(2)9)7(3)11-8(4)10/h1-4H3/b7-5-
InChIKey NIQBTDWZXCGVRD-ALCCZGGFSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdbjEBrrNEH
Name 3-Penten-2-one, 4-(acetyloxy)-3-methyl-, (Z)-
Alternate Name(s) (1Z)-1,2-dimethyl-3-oxo-1-butenyl acetate (Z)-4-(acetyloxy)-3-methyl-3-penten-2-one
CAS Registry Number 54678-17-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-5(6(2)9)7(3)11-8(4)10/h1-4H3/b7-5-
InChIKey NIQBTDWZXCGVRD-ALCCZGGFSA-N
Molecular Weight 156.181 g/mol
SMILES C(O\C(=C/(C(=O)C)C)C)(=O)C
SPLASH splash10-0006-9100000000-72409cd96322870ecf28
Source of Spectrum J-40-1467-0
Wiley ID 1153368