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3,5-Diphenyl-4-(2',4',6'-trideuterophenyl)isoxazole
SpectraBase Compound ID 7g2Ax0wfb6h
InChI InChI=1S/C21H15NO/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)22-23-21(19)18-14-8-3-9-15-18/h1-15H/i1D,10D,11D
InChIKey ZVOMKZHDZNGXPN-CNFJIJFTSA-N
Mol Weight 300.38 g/mol
Molecular Formula C21H122D3NO
Exact Mass 300.134194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C53N7rCqnl5
Name 3,5-Diphenyl-4-(2',4',6'-trideuterophenyl)isoxazole
CAS Registry Number 54833-50-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H12D3NO
InChI InChI=1S/C21H15NO/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)22-23-21(19)18-14-8-3-9-15-18/h1-15H/i1D,10D,11D
InChIKey ZVOMKZHDZNGXPN-CNFJIJFTSA-N
Molecular Weight 300.375 g/mol
SMILES c1(c(onc1-c1ccccc1)-c1ccccc1)-c1c(cc(cc1[2D])[2D])[2D]
SPLASH splash10-0a4i-4902000000-4be12835390c2b10a15f
Source of Spectrum O-2-746-8
Wiley ID 43994