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2-(bis(2-chloroethyl)amino)-3-(2-chlorobenzyl)-1-methyl-2,3-dihydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one
SpectraBase Compound ID GBtjrtUl0qL
InChI InChI=1S/C18H20Cl3N4OP/c1-23-17-15(6-4-10-22-17)18(26)25(13-14-5-2-3-7-16(14)21)27(23)24(11-8-19)12-9-20/h2-7,10H,8-9,11-13H2,1H3
InChIKey IZCMHLBPGWOETB-UHFFFAOYSA-N
Mol Weight 445.72 g/mol
Molecular Formula C18H20Cl3N4OP
Exact Mass 444.044031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLly14Xzplw
Name 2-(bis(2-chloroethyl)amino)-3-(2-chlorobenzyl)-1-methyl-2,3-dihydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20Cl3N4OP
InChI InChI=1S/C18H20Cl3N4OP/c1-23-17-15(6-4-10-22-17)18(26)25(13-14-5-2-3-7-16(14)21)27(23)24(11-8-19)12-9-20/h2-7,10H,8-9,11-13H2,1H3
InChIKey IZCMHLBPGWOETB-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3749(200002)626_2_412
Molecular Weight 445.718 g/mol
SMILES C1(N(P(N(c2c1cccn2)C)N(CCCl)CCCl)Cc1ccccc1Cl)=O
SPLASH splash10-0ufr-0609200000-025335da11eb551e0412
Source of Spectrum DZ-626-417-9
Wiley ID 1798234