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(S)-N,N'-Bis[1-(chloromethyl)-2-methylpropyl]ethanediamide

View entire compound with spectra: 1 MS (GC)

(S)-N,N'-Bis[1-(chloromethyl)-2-methylpropyl]ethanediamide
SpectraBase Compound ID KhMfyl4myFX
InChI InChI=1S/C12H22Cl2N2O2/c1-7(2)9(5-13)15-11(17)12(18)16-10(6-14)8(3)4/h7-10H,5-6H2,1-4H3,(H,15,17)(H,16,18)/t9-,10?/m1/s1
InChIKey SMZRKIYJYFISTE-YHMJZVADSA-N
Mol Weight 297.23 g/mol
Molecular Formula C12H22Cl2N2O2
Exact Mass 296.105833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SWUyQaRhLg
Name (S)-N,N'-Bis[1-(chloromethyl)-2-methylpropyl]ethanediamide
Alternate Name(s) N(1)-[(1S)-1-(chloromethyl)-2-methylpropyl]-N(2)-[1-(chloromethyl)-2-methylpropyl]ethanediamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22Cl2N2O2
InChI InChI=1S/C12H22Cl2N2O2/c1-7(2)9(5-13)15-11(17)12(18)16-10(6-14)8(3)4/h7-10H,5-6H2,1-4H3,(H,15,17)(H,16,18)/t9-,10?/m1/s1
InChIKey SMZRKIYJYFISTE-YHMJZVADSA-N
Molecular Weight 297.226 g/mol
SMILES N(C(C(NC(C(C)C)CCl)=O)=O)[C@@](C(C)C)(CCl)[H]
SPLASH splash10-014i-9000000000-8a3c8a2f99f2aafadb79
Source of Spectrum J-62-3386-5
Wiley ID 1298667