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2H-1,3,2-Oxazaphosphorine, 2-(1-aziridinyl)tetrahydro-3-(4-methylphenyl)-6-(4-nitrophenyl)-, 2-oxide
SpectraBase Compound ID Cl6sdFTNQzG
InChI InChI=1S/C18H20N3O4P/c1-14-2-6-16(7-3-14)20-11-10-18(25-26(20,24)19-12-13-19)15-4-8-17(9-5-15)21(22)23/h2-9,18H,10-13H2,1H3
InChIKey XSTHAWLCGRNTFB-UHFFFAOYSA-N
Mol Weight 373.35 g/mol
Molecular Formula C18H20N3O4P
Exact Mass 373.119143 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CW0uvQmHF0n
Name 2H-1,3,2-Oxazaphosphorine, 2-(1-aziridinyl)tetrahydro-3-(4-methylphenyl)-6-(4-nitrophenyl)-, 2-oxide
CAS Registry Number 89410-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N3O4P
InChI InChI=1S/C18H20N3O4P/c1-14-2-6-16(7-3-14)20-11-10-18(25-26(20,24)19-12-13-19)15-4-8-17(9-5-15)21(22)23/h2-9,18H,10-13H2,1H3
InChIKey XSTHAWLCGRNTFB-UHFFFAOYSA-N
Molecular Weight 373.349 g/mol
SMILES C1N(P2(N(CCC(O2)c2ccc(N(=O)=O)cc2)c2ccc(cc2)C)=O)C1
SPLASH splash10-00xr-0719000000-1ca13b8e9b4d8afd7688
Source of Spectrum O-18-490-1
Synonyms (3-(p-methylphenyl)-6-(p-nitrophenyl)-2-aziridino)tetrahydro-1,3,2-oxazaphosphorin-2-oxide 2-(1-aziridinyl)-3-(4-methylphenyl)-6-(4-nitrophenyl)tetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide
Wiley ID 1356035