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2-[Bis(2-chloroethyl)amino]-4-chlorothiazole-5-carbaldehyde
SpectraBase Compound ID IA3fVfkT8BK
InChI InChI=1S/C8H9Cl3N2OS/c9-1-3-13(4-2-10)8-12-7(11)6(5-14)15-8/h5H,1-4H2
InChIKey RIDQQIALPHYOHG-UHFFFAOYSA-N
Mol Weight 287.59 g/mol
Molecular Formula C8H9Cl3N2OS
Exact Mass 285.950117 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9HHD0FJdlL7
Name 2-[Bis(2-chloroethyl)amino]-4-chlorothiazole-5-carbaldehyde
Appearance Pale yellow crystals
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Formula C8H9Cl3N2OS
InChI InChI=1S/C8H9Cl3N2OS/c9-1-3-13(4-2-10)8-12-7(11)6(5-14)15-8/h5H,1-4H2
InChIKey RIDQQIALPHYOHG-UHFFFAOYSA-N
Instrument Name Shimadzu-GCMS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ardp.201900351
Molecular Weight 287.592 g/mol
SMILES c1(sc(c(n1)Cl)C=O)N(CCCl)CCCl
SPLASH splash10-002r-3490000000-e4c36aa169d8814859f6
Source of Spectrum APC-353-12-3
Wiley ID 1839645