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1-(Methoxycarbonyl)-5-chloro-4-methoxy-3-methylpentan-2-one
SpectraBase Compound ID AffIKNGKTG5
InChI InChI=1S/C9H15ClO4/c1-6(8(5-10)13-2)7(11)4-9(12)14-3/h6,8H,4-5H2,1-3H3
InChIKey NNJJTWFFFKVRPN-UHFFFAOYSA-N
Mol Weight 222.67 g/mol
Molecular Formula C9H15ClO4
Exact Mass 222.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pYr8QknZKN
Name 1-(Methoxycarbonyl)-5-chloro-4-methoxy-3-methylpentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15ClO4
InChI InChI=1S/C9H15ClO4/c1-6(8(5-10)13-2)7(11)4-9(12)14-3/h6,8H,4-5H2,1-3H3
InChIKey NNJJTWFFFKVRPN-UHFFFAOYSA-N
Molecular Weight 222.668 g/mol
SMILES C(C(C(C(CCl)OC)C)=O)C(=O)OC
SPLASH splash10-00di-0900000000-c7d85ec2db410c2fb86f
Source of Spectrum H-2005-2080-3
Synonyms Methyl 6-chloro-5-methoxy-4-methyl-3-oxohexanoate
Wiley ID 1562723