2-[Bis(2-chlorethyl)amino]-1,2-dihydro-1-methyl-4,4-bis(trifluormethyl)-3,1,2-benzoxazaphosphepin-5(4H)-one-2-oxide

SpectraBase Compound ID	Dc0QmjFCYNR
InChI	InChI=1S/C15H15Cl2F6N2O3P/c1-24-11-5-3-2-4-10(11)12(26)13(14(18,19)20,15(21,22)23)28-29(24,27)25(8-6-16)9-7-17/h2-5H,6-9H2,1H3
InChIKey	BCZRCRQEJPVBLT-UHFFFAOYSA-N Google Search
Mol Weight	487.17 g/mol
Molecular Formula	C15H15Cl2F6N2O3P
Exact Mass	486.010154 g/mol

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SpectraBase Spectrum ID	FdvZIPgtTwl
Name	2-[Bis(2-chlorethyl)amino]-1,2-dihydro-1-methyl-4,4-bis(trifluormethyl)-3,1,2-benzoxazaphosphepin-5(4H)-one-2-oxide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H15Cl2F6N2O3P
InChI	InChI=1S/C15H15Cl2F6N2O3P/c1-24-11-5-3-2-4-10(11)12(26)13(14(18,19)20,15(21,22)23)28-29(24,27)25(8-6-16)9-7-17/h2-5H,6-9H2,1H3
InChIKey	BCZRCRQEJPVBLT-UHFFFAOYSA-N
Literature Reference DOI	10.1002/cber.19961290620
Molecular Weight	487.166 g/mol
SMILES	C(C1(C(F)(F)F)C(c2c(N(C)P(=O)(N(CCCl)CCCl)O1)cccc2)=O)(F)(F)F
SPLASH	splash10-000i-0102900000-b8b4556f5e19e82b49e0
Source of Spectrum	K-129-729-2
Synonyms	2-(bis(2-chloroethyl)amino)-1-methyl-4,4-bis(trifluoromethyl)-1-hydrobenzo[d][1,3,2]oxazaphosphepin-5(4H)-one 2-oxide
Wiley ID	1790551