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N-Chloroacetyl ?-Aminocaproic Acid Methyl Ester
SpectraBase Compound ID DD3um15rrog
InChI InChI=1S/C9H16ClNO3/c1-14-9(13)5-3-2-4-6-11-8(12)7-10/h2-7H2,1H3,(H,11,12)
InChIKey CMFGCDWVVQDVNC-UHFFFAOYSA-N
Mol Weight 221.68 g/mol
Molecular Formula C9H16ClNO3
Exact Mass 221.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7sI7mBM3WJ
Name N-Chloroacetyl ?-Aminocaproic Acid Methyl Ester
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16ClNO3
InChI InChI=1S/C9H16ClNO3/c1-14-9(13)5-3-2-4-6-11-8(12)7-10/h2-7H2,1H3,(H,11,12)
InChIKey CMFGCDWVVQDVNC-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.5b00621
Molecular Weight 221.684 g/mol
Reported Formula C9H16ClNO3
SMILES N(C(CCl)=O)CCCCCC(OC)=O
SPLASH splash10-000i-0900000000-9178466ec8ebd74340be
Source of Spectrum AF-58-6526-8a
Wiley ID 1865503