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2-[Bis-(2-chloro-ethyl)-amino]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3,8-triaza-2lambda-5-phospha-naphthalen-4-one
SpectraBase Compound ID DJnGdUilLaq
InChI InChI=1S/C12H17Cl2N4O2P/c1-16-11-10(4-3-7-15-11)12(19)17(2)21(16,20)18(8-5-13)9-6-14/h3-4,7H,5-6,8-9H2,1-2H3
InChIKey ZKOAUXWUDJXLLX-UHFFFAOYSA-N
Mol Weight 351.17 g/mol
Molecular Formula C12H17Cl2N4O2P
Exact Mass 350.046618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Be9wm2UUdQ
Name 2-[Bis-(2-chloro-ethyl)-amino]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3,8-triaza-2lambda-5-phospha-naphthalen-4-one
Alternate Name(s) 2-(bis(2-chloroethyl)amino)-1,3-dimethyl-3-hydropyrido[2,3-d][1,3,2]diazaphosphinin-4(1H)-one 2-oxide
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Formula C12H17Cl2N4O2P
InChI InChI=1S/C12H17Cl2N4O2P/c1-16-11-10(4-3-7-15-11)12(19)17(2)21(16,20)18(8-5-13)9-6-14/h3-4,7H,5-6,8-9H2,1-2H3
InChIKey ZKOAUXWUDJXLLX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19951280616
Molecular Weight 351.174 g/mol
SMILES c1cc2c(nc1)N(P(N(C2=O)C)(N(CCCl)CCCl)=O)C
SPLASH splash10-0ik9-0493000000-0dbca7be12d24a6edefb
Source of Spectrum K-128-632-14
Wiley ID 1790528