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Diphenyl (4-hydroxy-3-methoxyphenyl) (5-methyl-1,3,4-thiadiazol-2-ylamino)methylphosphonate
SpectraBase Compound ID EsEahvbMSuE
InChI InChI=1S/C23H22N3O5PS/c1-16-25-26-23(33-16)24-22(17-13-14-20(27)21(15-17)29-2)32(28,30-18-9-5-3-6-10-18)31-19-11-7-4-8-12-19/h3-15,22,27H,1-2H3,(H,24,26)
InChIKey KUFDKAKFAGKGJY-UHFFFAOYSA-N
Mol Weight 483.48 g/mol
Molecular Formula C23H22N3O5PS
Exact Mass 483.101779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4foIoCSa5Q
Name Diphenyl (4-hydroxy-3-methoxyphenyl) (5-methyl-1,3,4-thiadiazol-2-ylamino)methylphosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 483.101778987 u
Formula C23H22N3O5PS
InChI InChI=1S/C23H22N3O5PS/c1-16-25-26-23(33-16)24-22(17-13-14-20(27)21(15-17)29-2)32(28,30-18-9-5-3-6-10-18)31-19-11-7-4-8-12-19/h3-15,22,27H,1-2H3,(H,24,26)
InChIKey KUFDKAKFAGKGJY-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1016/j.jscs.2017.06.002
Molecular Weight 483.479 g/mol
SMILES N(C=1SC(=NN1)C)C(C1=CC(=C(C=C1)O)OC)P(OC1=CC=CC=C1)(OC1=CC=CC=C1)=O
SPLASH splash10-03dl-7000900000-e2c62819eac4816e3b2a
Source of Spectrum SCS-22-35-3 (DOI: 10.1016/j.jscs.2017.06.002)
Wiley ID 1892604