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2,2-Dimethyl-1,3-propanediol dichloroacetate
SpectraBase Compound ID HPzl8NBNFR7
InChI InChI=1S/C9H14Cl2O4/c1-9(2,3-7(12)15-6-11)5-14-8(13)4-10/h3-6H2,1-2H3
InChIKey QOVQVFCJYSSSNI-UHFFFAOYSA-N
Mol Weight 257.11 g/mol
Molecular Formula C9H14Cl2O4
Exact Mass 256.026914 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7GreR1qa3E
Name 2,2-Dimethyl-1,3-propanediol dichloroacetate
Alternate Name(s) Chloromethyl 4-[(chloroacetyl)oxy]-3,3-dimethylbutanoate
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Formula C9H14Cl2O4
InChI InChI=1S/C9H14Cl2O4/c1-9(2,3-7(12)15-6-11)5-14-8(13)4-10/h3-6H2,1-2H3
InChIKey QOVQVFCJYSSSNI-UHFFFAOYSA-N
Molecular Weight 257.113 g/mol
SMILES C(OCCl)(=O)CC(COC(=O)CCl)(C)C
SPLASH splash10-0a6s-9100000000-49d3599db30d764b51df
Source of Spectrum IC-709-0-0
Wiley ID 1259185