For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
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
Mol Weight 487.17 g/mol
Molecular Formula C15H15Cl2F6N2O3P
Exact Mass 486.010154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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
Alternate Name(s) 2-(bis(2-chloroethyl)amino)-1-methyl-4,4-bis(trifluoromethyl)-1-hydrobenzo[d][1,3,2]oxazaphosphepin-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
Wiley ID 1790551