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(Z)-3-(dimethylamino)-1-(2,3,4,5,6-pentadeuteriophenyl)-2-(1-phenyl-1,2,3,4-tetrazol-5-yl)prop-2-en-1-one
SpectraBase Compound ID 5bTW46bsYwL
InChI InChI=1S/C18H17N5O/c1-22(2)13-16(17(24)14-9-5-3-6-10-14)18-19-20-21-23(18)15-11-7-4-8-12-15/h3-13H,1-2H3/b16-13+/i3D,5D,6D,9D,10D
InChIKey PSMRDIADNIHJFE-CVACHAHPSA-N
Mol Weight 324.4 g/mol
Molecular Formula C18H122D5N5O
Exact Mass 324.174694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHdkGyH0OwE
Name (Z)-3-(dimethylamino)-1-(2,3,4,5,6-pentadeuteriophenyl)-2-(1-phenyl-1,2,3,4-tetrazol-5-yl)prop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12D5N5O
InChI InChI=1S/C18H17N5O/c1-22(2)13-16(17(24)14-9-5-3-6-10-14)18-19-20-21-23(18)15-11-7-4-8-12-15/h3-13H,1-2H3/b16-13+/i3D,5D,6D,9D,10D
InChIKey PSMRDIADNIHJFE-CVACHAHPSA-N
Molecular Weight 324.399 g/mol
SMILES c1(\C(C(=O)c2c(c([2D])c(c(c2[2D])[2D])[2D])[2D])=C\N(C)C)[n](nnn1)-c1ccccc1
SPLASH splash10-001i-9530000000-71269d58a36be737411c
Source of Spectrum Y-33-816-1
Synonyms (Z)-3-(dimethylamino)-1-(2,3,4,5,6-pentadeuteriophenyl)-2-(1-phenyl-5-tetrazolyl)-2-propen-1-one (Z)-3-(dimethylamino)-1-(2,3,4,5,6-pentadeuteriophenyl)-2-(1-phenyltetrazol-5-yl)prop-2-en-1-one
Wiley ID 1319381