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2H-1,3,2-Oxazaphosphorine, acetamide deriv.
SpectraBase Compound ID EYALhoCVAiT
InChI InChI=1S/C15H21Cl2N2O3P/c1-13(14-6-3-2-4-7-14)18-9-5-11-22-23(18,21)19(10-8-16)15(20)12-17/h2-4,6-7,13H,5,8-12H2,1H3/t13-,23+/m0/s1
InChIKey UXVJUCWDJXMDMB-ZAMGYDSWSA-N
Mol Weight 379.22 g/mol
Molecular Formula C15H21Cl2N2O3P
Exact Mass 378.066685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lh8YpRlK3j3
Name 2H-1,3,2-Oxazaphosphorine, acetamide deriv.
Alternate Name(s) Acetamide, 2-chloro-N-(2-chloroethyl)-N-[tetrahydro-3-(1-phenylethyl)-2H-1,3,2-o xazaphosphorin-2-yl]-, P-oxide, [S-(R*,S*)]- 2(S)-((N-(2-chloroethyl)-N-chloroacetyl)amino)-3-((R)-.alpha.-methylbenzyl)tetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide 2-Chloro-N-(2-chloroethyl)-N-{2-oxido-3-[(1S)-1-phenylethyl]tetrahydro-2H-1,3,2-oxazaphosphorin-2-yl}acetamide
CAS Registry Number 72578-78-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21Cl2N2O3P
InChI InChI=1S/C15H21Cl2N2O3P/c1-13(14-6-3-2-4-7-14)18-9-5-11-22-23(18,21)19(10-8-16)15(20)12-17/h2-4,6-7,13H,5,8-12H2,1H3/t13-,23+/m0/s1
InChIKey UXVJUCWDJXMDMB-ZAMGYDSWSA-N
Molecular Weight 379.224 g/mol
SMILES [C@](N1[P@@](OCCC1)(N(C(=O)CCl)CCCl)=O)(c1ccccc1)(C)[H]
SPLASH splash10-066r-0910000000-ad3eaf45616eca900d2d
Source of Spectrum C-101-7717-0
Wiley ID 1358495