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Spiro[4'-(4"-Methylphenyl)-1'-phenylpyrimidine-5-(ethoxycarbonyl)-3-phenyl-2(1H),2'(3'H)-[1,3,4]thiadiazole
SpectraBase Compound ID 98H91N8JW9i
InChI InChI=1S/C27H24N4O2S/c1-3-33-26(32)25-29-31(23-12-8-5-9-13-23)27(34-25)28-24(21-16-14-20(2)15-17-21)18-19-30(27)22-10-6-4-7-11-22/h4-19H,3H2,1-2H3
InChIKey RDOUQQITBRNROG-UHFFFAOYSA-N
Mol Weight 468.58 g/mol
Molecular Formula C27H24N4O2S
Exact Mass 468.161997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vXv58X0SWv
Name Spiro[4'-(4"-Methylphenyl)-1'-phenylpyrimidine-5-(ethoxycarbonyl)-3-phenyl-2(1H),2'(3'H)-[1,3,4]thiadiazole
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N4O2S
InChI InChI=1S/C27H24N4O2S/c1-3-33-26(32)25-29-31(23-12-8-5-9-13-23)27(34-25)28-24(21-16-14-20(2)15-17-21)18-19-30(27)22-10-6-4-7-11-22/h4-19H,3H2,1-2H3
InChIKey RDOUQQITBRNROG-UHFFFAOYSA-N
Molecular Weight 468.575 g/mol
SMILES C12(SC(C(=O)OCC)=NN2c2ccccc2)N=C(c2ccc(cc2)C)C=CN1c1ccccc1
SPLASH splash10-004i-9001000000-68cc90f8369586814d00
Source of Spectrum U-1994-1007-9
Wiley ID 766186