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Methyl (2E)-5-(acetyloxy)-4-oxo-2-hexenoate
SpectraBase Compound ID 8aiIYvbLEeY
InChI InChI=1S/C9H12O5/c1-6(14-7(2)10)8(11)4-5-9(12)13-3/h4-6H,1-3H3/b5-4+
InChIKey IJNTWYDINNXFSD-SNAWJCMRSA-N
Mol Weight 200.19 g/mol
Molecular Formula C9H12O5
Exact Mass 200.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLQYOD1JFKx
Name Methyl (2E)-5-(acetyloxy)-4-oxo-2-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O5
InChI InChI=1S/C9H12O5/c1-6(14-7(2)10)8(11)4-5-9(12)13-3/h4-6H,1-3H3/b5-4+
InChIKey IJNTWYDINNXFSD-SNAWJCMRSA-N
Molecular Weight 200.190 g/mol
SMILES C(=O)(C(OC(C)=O)C)\C=C\C(=O)OC
SPLASH splash10-01ox-9600000000-8bf75ec6255371ef6f94
Synonyms (E)-5-acetoxy-4-keto-hex-2-enoic acid methyl ester (E)-5-acetyloxy-4-oxo-2-hexenoic acid methyl ester 5-Acetoxy-4-oxohex-2-enoic acid, methyl ester Methyl (E)-5-acetoxy-4-oxo-hex-2-enoate Methyl (E)-5-acetyloxy-4-oxidanylidene-hex-2-enoate Methyl (E)-5-acetyloxy-4-oxohex-2-enoate
Wiley ID 1481587