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Chlorambucil ME
SpectraBase Compound ID KKXGeQC2qg
InChI InChI=1S/C15H21Cl2NO2/c1-20-15(19)4-2-3-13-5-7-14(8-6-13)18(11-9-16)12-10-17/h5-8H,2-4,9-12H2,1H3
InChIKey PNAAJAGDSYYODD-UHFFFAOYSA-N
Mol Weight 318.24 g/mol
Molecular Formula C15H21Cl2NO2
Exact Mass 317.094934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8f3gqcCGfxw
Name Chlorambucil ME
Classification Antineoplastic
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Exact Mass 317.094934318 u
Formula C15H21Cl2NO2
InChI InChI=1S/C15H21Cl2NO2/c1-20-15(19)4-2-3-13-5-7-14(8-6-13)18(11-9-16)12-10-17/h5-8H,2-4,9-12H2,1H3
InChIKey PNAAJAGDSYYODD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 318.244 g/mol
SMILES c1(ccc(CCCC(OC)=O)cc1)N(CCCl)CCCl
SPLASH splash10-014i-1591000000-4a4f8ca8fec5eb37e8f3
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1781