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.beta.-alanine, N-(3-chloropropyl)-N-propyl-, methyl ester
SpectraBase Compound ID ECvGctK2aSn
InChI InChI=1S/C10H20ClNO2/c1-3-7-12(8-4-6-11)9-5-10(13)14-2/h3-9H2,1-2H3
InChIKey JEFGFAAARWRFDT-UHFFFAOYSA-N
Mol Weight 221.73 g/mol
Molecular Formula C10H20ClNO2
Exact Mass 221.118257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ivmzx7i48S9
Name .beta.-alanine, N-(3-chloropropyl)-N-propyl-, methyl ester
Alternate Name(s) Methyl 3-((3-chloropropyl)(propyl)amino)propanoate Methyl N-(3-chloropropyl)-N-propyl-.beta.-alaninate 3-[3-chloropropyl(propyl)amino]propanoic acid methyl ester Methyl 3-[3-chloropropyl(propyl)amino]propanoate Methyl 3-[3-chloranylpropyl(propyl)amino]propanoate
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Formula C10H20ClNO2
InChI InChI=1S/C10H20ClNO2/c1-3-7-12(8-4-6-11)9-5-10(13)14-2/h3-9H2,1-2H3
InChIKey JEFGFAAARWRFDT-UHFFFAOYSA-N
Molecular Weight 221.728 g/mol
SMILES CCCN(CCCCl)CCC(=O)OC
SPLASH splash10-0596-9300000000-8544902bce227954cf25
Source of Spectrum JX-2015-0-482
Wiley ID 1720420