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5H-Cyclopenta[b]pyridine-3-carbonitrile, 1,2,6,7-tetrahydro-1-[2-(4-bromophenyl)-2-oxoethyl]-2-thioxo-
SpectraBase Compound ID DN2SeOs2Ko9
InChI InChI=1S/C17H13BrN2OS/c18-14-6-4-11(5-7-14)16(21)10-20-15-3-1-2-12(15)8-13(9-19)17(20)22/h4-8H,1-3,10H2
InChIKey SXXYXHUNLCBBDA-UHFFFAOYSA-N
Mol Weight 373.27 g/mol
Molecular Formula C17H13BrN2OS
Exact Mass 371.993197 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1r9dz5peCW
Name 5H-Cyclopenta[b]pyridine-3-carbonitrile, 1,2,6,7-tetrahydro-1-[2-(4-bromophenyl)-2-oxoethyl]-2-thioxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrN2OS
InChI InChI=1S/C17H13BrN2OS/c18-14-6-4-11(5-7-14)16(21)10-20-15-3-1-2-12(15)8-13(9-19)17(20)22/h4-8H,1-3,10H2
InChIKey SXXYXHUNLCBBDA-UHFFFAOYSA-N
Molecular Weight 373.268 g/mol
SMILES C1CC=2N(C(C(C#N)=CC2C1)=S)CC(c1ccc(cc1)Br)=O
SPLASH splash10-000i-5900000000-a459307972456bdf2240
Synonyms 1-[2-(4-bromophenyl)-2-keto-ethyl]-2-thioxo-6,7-dihydro-5H-1-pyrindine-3-carbonitrile 1-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-2-sulfanylidene-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 1-[2-(4-bromophenyl)-2-oxo-ethyl]-2-thioxo-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 1-[2-(4-bromophenyl)-2-oxoethyl]-2-sulfanylidene-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 1-[2-(4-Bromophenyl)-2-oxoethyl]-2-thioxo-2,5,6,7-tetrahydro-1H-cyclopenta[b]pyridine-3-carbonitrile
Wiley ID 1440441