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4,5-Diphenyl-3-methyl-2-[(3,7-dimethyl-6-purinylidene)methyl]oxazolium iodide
SpectraBase Compound ID 366Vn17pQdT
InChI InChI=1S/C24H22N5O.HI/c1-27-16-26-24-22(27)19(25-15-28(24)2)14-20-29(3)21(17-10-6-4-7-11-17)23(30-20)18-12-8-5-9-13-18;/h4-16H,1-3H3;1H/q+1;/p-1
InChIKey UZPYMRAUQDVASU-UHFFFAOYSA-M
Mol Weight 523.38 g/mol
Molecular Formula C24H22IN5O
Exact Mass 523.086905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2W4r81qFP2l
Name 4,5-Diphenyl-3-methyl-2-[(3,7-dimethyl-6-purinylidene)methyl]oxazolium iodide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22IN5O
InChI InChI=1S/C24H22N5O.HI/c1-27-16-26-24-22(27)19(25-15-28(24)2)14-20-29(3)21(17-10-6-4-7-11-17)23(30-20)18-12-8-5-9-13-18;/h4-16H,1-3H3;1H/q+1;/p-1
InChIKey UZPYMRAUQDVASU-UHFFFAOYSA-M
Molecular Weight 523.378 g/mol
SMILES [I-].c1([n+](c(c(o1)-c1ccccc1)-c1ccccc1)C)\C=C\1c2c(nc[n]2C)N(C=N1)C
SPLASH splash10-0006-0903000000-dfbe5a9b45f14796f169
Source of Spectrum F-53-11602-12
Synonyms 2-[(Z)-(3,7-dimethyl-3,7-dihydro-6H-purin-6-ylidene)methyl]-3-methyl-4,5-diphenyl-1,3-oxazol-3-ium iodide
Wiley ID 803561