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6-(2,2-Dicyano-1-methylvinyl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine

View entire compound with spectra: 1 MS (GC)

6-(2,2-Dicyano-1-methylvinyl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
SpectraBase Compound ID G4ahyDZbD85
InChI InChI=1S/C22H15N5S/c1-14(17(12-23)13-24)20-19(27-10-6-7-11-27)18-15(2)25-21(26-22(18)28-20)16-8-4-3-5-9-16/h3-11H,1-2H3
InChIKey LJJCVJYUAVXTIR-UHFFFAOYSA-N
Mol Weight 381.46 g/mol
Molecular Formula C22H15N5S
Exact Mass 381.104817 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AmoakM6Hw5
Name 6-(2,2-Dicyano-1-methylvinyl)-5-(1-pyrrolyl)-4-methyl-2-phenylthieno[2,3-d]pyrimidine
Alternate Name(s) 2-(1-(4-methyl-2-phenyl-5-(1H-pyrrol-1-yl)thieno[2,3-d]pyrimidin-6-yl)ethylidene)malononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H15N5S
InChI InChI=1S/C22H15N5S/c1-14(17(12-23)13-24)20-19(27-10-6-7-11-27)18-15(2)25-21(26-22(18)28-20)16-8-4-3-5-9-16/h3-11H,1-2H3
InChIKey LJJCVJYUAVXTIR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200500048
Molecular Weight 381.457 g/mol
SMILES c1(nc2c(c(n1)C)c(c(s2)C(=C(C#N)C#N)C)-[n]1cccc1)-c1ccccc1
SPLASH splash10-001i-2319000000-eb387f598a3010deeb9a
Source of Spectrum QA-52-320-10
Wiley ID 1796088