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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 2-oxide
SpectraBase Compound ID HIUDpybRJyG
InChI InChI=1S/C18H20Cl3N4O2P/c1-23-17-15(6-4-10-22-17)18(26)25(13-14-5-2-3-7-16(14)21)28(23,27)24(11-8-19)12-9-20/h2-7,10H,8-9,11-13H2,1H3
InChIKey YEXLGSKORRKYTN-UHFFFAOYSA-N
Mol Weight 461.72 g/mol
Molecular Formula C18H20Cl3N4O2P
Exact Mass 460.038946 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nKyUF3DTJx
Name 2-[bis(2-chloroethyl)amino]-3-(2-chlorobenzyl)-1-methyl-2,3-dihydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one 2-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20Cl3N4O2P
InChI InChI=1S/C18H20Cl3N4O2P/c1-23-17-15(6-4-10-22-17)18(26)25(13-14-5-2-3-7-16(14)21)28(23,27)24(11-8-19)12-9-20/h2-7,10H,8-9,11-13H2,1H3
InChIKey YEXLGSKORRKYTN-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3749(200002)626_2_412
Molecular Weight 461.717 g/mol
SMILES c1cc2c(nc1)N(P(N(C2=O)Cc1ccccc1Cl)(=O)N(CCCl)CCCl)C
SPLASH splash10-004i-0302900000-ce8bd3b90eeedd9319cc
Source of Spectrum DZ-626-418-15
Synonyms 2-(bis(2-chloroethyl)amino)-3-(2-chlorobenzyl)-1-methyl-3-hydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one 2-oxide
Wiley ID 1798220