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Diisopropyl [4-(4-methylphenyl)-1H-benzoxazin-1-yl]-phosphonate
SpectraBase Compound ID 8Tb17645se9
InChI InChI=1S/C21H26NO4P/c1-14(2)25-27(23,26-15(3)4)21-19-9-7-6-8-18(19)20(22-24-21)17-12-10-16(5)11-13-17/h6-15,21H,1-5H3
InChIKey JZSJSZBGWMOFHQ-UHFFFAOYSA-N
Mol Weight 387.42 g/mol
Molecular Formula C21H26NO4P
Exact Mass 387.159945 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzMMoUK0pTk
Name Diisopropyl [4-(4-methylphenyl)-1H-benzoxazin-1-yl]-phosphonate
Alternate Name(s) Diisopropyl (4-(p-tolyl)-1H-benzo[d][1,2]oxazin-1-yl)phosphonate 1-Di(propan-2-yloxy)phosphoryl-4-(4-methylphenyl)-1H-2,3-benzoxazine
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Formula C21H26NO4P
InChI InChI=1S/C21H26NO4P/c1-14(2)25-27(23,26-15(3)4)21-19-9-7-6-8-18(19)20(22-24-21)17-12-10-16(5)11-13-17/h6-15,21H,1-5H3
InChIKey JZSJSZBGWMOFHQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.10216
Molecular Weight 387.416 g/mol
SMILES c1ccc2C(=NOC(c2c1)P(OC(C)C)(OC(C)C)=O)c1ccc(cc1)C
SPLASH splash10-0ap0-1496000000-bcf27266b4438662edcd
Source of Spectrum HAC-15-81-5c
Wiley ID 1775989