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1,2-Dichloropropane
SpectraBase Compound ID GhveAhzABi1
InChI InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3
InChIKey KNKRKFALVUDBJE-UHFFFAOYSA-N
Mol Weight 112.99 g/mol
Molecular Formula C3H6Cl2
Exact Mass 111.984656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0ViX48GLBE
Name 1,2-Dichloropropane
Source of Sample Sigma-Aldrich Cat. #02577
CAS Registry Number 78-87-5
Classification Pesticides: Insecticides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 111.984655593 u
Formula C3H6Cl2
InChI InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3
InChIKey KNKRKFALVUDBJE-UHFFFAOYSA-N
Molecular Weight 112.987 g/mol
Number of Peaks 45
RI1 707
SMILES CC(CCl)Cl
SPLASH splash10-03di-9000000000-5b07ec37fa78da989e66
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Propane, 1,2-dichloro-
Wiley ID LM_PEST_343