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(E)-Ethyl 3-methyl-4-oxohept-2-enoate
SpectraBase Compound ID AxqojCPLsSK
InChI InChI=1S/C10H16O3/c1-4-6-9(11)8(3)7-10(12)13-5-2/h7H,4-6H2,1-3H3/b8-7+
InChIKey KIBGLIWLACXMIO-BQYQJAHWSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID q2NcnDSY8x
Name (E)-Ethyl 3-methyl-4-oxohept-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-4-6-9(11)8(3)7-10(12)13-5-2/h7H,4-6H2,1-3H3/b8-7+
InChIKey KIBGLIWLACXMIO-BQYQJAHWSA-N
Literature Reference DOI 10.1002/cctc.201801040
Molecular Weight 184.235 g/mol
SMILES C(C)OC(\C=C\(C(CCC)=O)C)=O
SPLASH splash10-01p6-7900000000-b6760fcecd9cf6392a29
Source of Spectrum CCC-10-SM12-(E)_2b
Synonyms Ethyl (E)-3-methyl-4-oxohept-2-enoate
Wiley ID 1812732