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Diphenyl 1-(5-methyl-1,3,4-thiadiazol-2-ylamino)-3-phenylallyl phosphonate
SpectraBase Compound ID 70EoDx847Iv
InChI InChI=1S/C24H22N3O3PS/c1-19-26-27-24(32-19)25-23(18-17-20-11-5-2-6-12-20)31(28,29-21-13-7-3-8-14-21)30-22-15-9-4-10-16-22/h2-18,23H,1H3,(H,25,27)
InChIKey IAFGUDXFCGKVPF-UHFFFAOYSA-N
Mol Weight 463.49 g/mol
Molecular Formula C24H22N3O3PS
Exact Mass 463.11195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Tj6g5HrEP3
Name Diphenyl 1-(5-methyl-1,3,4-thiadiazol-2-ylamino)-3-phenylallyl phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.111949749 u
Formula C24H22N3O3PS
InChI InChI=1S/C24H22N3O3PS/c1-19-26-27-24(32-19)25-23(18-17-20-11-5-2-6-12-20)31(28,29-21-13-7-3-8-14-21)30-22-15-9-4-10-16-22/h2-18,23H,1H3,(H,25,27)
InChIKey IAFGUDXFCGKVPF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1016/j.jscs.2017.06.002
Molecular Weight 463.492 g/mol
Quality 105
SMILES N(C=1SC(=NN1)C)C(P(OC1=CC=CC=C1)(OC1=CC=CC=C1)=O)C=CC1=CC=CC=C1
SPLASH splash10-00ox-9056200000-a1a194830561e497f06d
Source of Spectrum SCS-22-35-4 (DOI: 10.1016/j.jscs.2017.06.002)
Wiley ID 1892605