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2-[(P,P-Diethoxy)phosphono(p-methylbenzyl)oxy]-1,3,2-benzoxazaphosphole - 2-sulfide
SpectraBase Compound ID Jv99Uc5XFtp
InChI InChI=1S/C18H23NO5P2S/c1-4-21-25(20,22-5-2)18(15-12-10-14(3)11-13-15)24-26(27)19-16-8-6-7-9-17(16)23-26/h6-13,18H,4-5H2,1-3H3,(H,19,27)
InChIKey ZLZJLRIDGMMRQR-UHFFFAOYSA-N
Mol Weight 427.39 g/mol
Molecular Formula C18H23NO5P2S
Exact Mass 427.077218 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADCODwo0hH2
Name 2-[(P,P-Diethoxy)phosphono(p-methylbenzyl)oxy]-1,3,2-benzoxazaphosphole - 2-sulfide
Alternate Name(s) Diethyl (4-methylphenyl)[(2-sulfido-2,3-dihydro-1,3,2-benzoxazaphosphol-2-yl)oxy]methylphosphonate
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Formula C18H23NO5P2S
InChI InChI=1S/C18H23NO5P2S/c1-4-21-25(20,22-5-2)18(15-12-10-14(3)11-13-15)24-26(27)19-16-8-6-7-9-17(16)23-26/h6-13,18H,4-5H2,1-3H3,(H,19,27)
InChIKey ZLZJLRIDGMMRQR-UHFFFAOYSA-N
Molecular Weight 427.392 g/mol
SMILES N1c2ccccc2OP1(OC(P(=O)(OCC)OCC)c1ccc(cc1)C)=S
SPLASH splash10-0bt9-5922000000-f048a73c629a884d239b
Source of Spectrum OP-30-718-6
Wiley ID 850881