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2-(bis(2-chloroethyl)amino)-3-(4-fluorobenzyl)-1-methyl-2,3-dihydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one
SpectraBase Compound ID KQSvyDD74bI
InChI InChI=1S/C18H20Cl2FN4OP/c1-23-17-16(3-2-10-22-17)18(26)25(13-14-4-6-15(21)7-5-14)27(23)24(11-8-19)12-9-20/h2-7,10H,8-9,11-13H2,1H3
InChIKey POBCJKWZTQXZKO-UHFFFAOYSA-N
Mol Weight 429.26 g/mol
Molecular Formula C18H20Cl2FN4OP
Exact Mass 428.073582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L2BvGAq4RAi
Name 2-(bis(2-chloroethyl)amino)-3-(4-fluorobenzyl)-1-methyl-2,3-dihydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20Cl2FN4OP
InChI InChI=1S/C18H20Cl2FN4OP/c1-23-17-16(3-2-10-22-17)18(26)25(13-14-4-6-15(21)7-5-14)27(23)24(11-8-19)12-9-20/h2-7,10H,8-9,11-13H2,1H3
InChIKey POBCJKWZTQXZKO-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-3749(200002)626_2_412
Molecular Weight 429.263 g/mol
SMILES C1(N(P(N(c2c1cccn2)C)N(CCCl)CCCl)Cc1ccc(cc1)F)=O
SPLASH splash10-0aor-0829200000-2916ebfe01096ad79e9b
Source of Spectrum DZ-626-417-10
Wiley ID 1798217