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1-(Ethoxycarbonyl)-5-chloro-4-methoxy-3-butylpentan-2-one
SpectraBase Compound ID BWqbkHyC8MK
InChI InChI=1S/C13H23ClO4/c1-4-6-7-10(12(9-14)17-3)11(15)8-13(16)18-5-2/h10,12H,4-9H2,1-3H3
InChIKey KLVJIGSYMYPPRD-UHFFFAOYSA-N
Mol Weight 278.78 g/mol
Molecular Formula C13H23ClO4
Exact Mass 278.128487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GduhaRlKnUw
Name 1-(Ethoxycarbonyl)-5-chloro-4-methoxy-3-butylpentan-2-one
Alternate Name(s) Ethyl 4-(2-chloro-1-methoxyethyl)-3-oxooctanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23ClO4
InChI InChI=1S/C13H23ClO4/c1-4-6-7-10(12(9-14)17-3)11(15)8-13(16)18-5-2/h10,12H,4-9H2,1-3H3
InChIKey KLVJIGSYMYPPRD-UHFFFAOYSA-N
Molecular Weight 278.776 g/mol
SMILES C(CC(=O)OCC)(C(C(OC)CCl)CCCC)=O
SPLASH splash10-016r-0090000000-fce95f51b7d4e0a42629
Source of Spectrum H-2005-2080-3
Wiley ID 1562718