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4-Amino-5-(4-chlorobenzoyl)-2-(1-pyrrolidinyl)-3-thiophenecarbonitrile

View entire compound with spectra: 1 MS (GC)

4-Amino-5-(4-chlorobenzoyl)-2-(1-pyrrolidinyl)-3-thiophenecarbonitrile
SpectraBase Compound ID 1WOoCC1IuHE
InChI InChI=1S/C16H14ClN3OS/c17-11-5-3-10(4-6-11)14(21)15-13(19)12(9-18)16(22-15)20-7-1-2-8-20/h3-6H,1-2,7-8,19H2
InChIKey FKTJKMMVZTUAQE-UHFFFAOYSA-N
Mol Weight 331.82 g/mol
Molecular Formula C16H14ClN3OS
Exact Mass 331.054611 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A0jJQG7lo7d
Name 4-Amino-5-(4-chlorobenzoyl)-2-(1-pyrrolidinyl)-3-thiophenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClN3OS
InChI InChI=1S/C16H14ClN3OS/c17-11-5-3-10(4-6-11)14(21)15-13(19)12(9-18)16(22-15)20-7-1-2-8-20/h3-6H,1-2,7-8,19H2
InChIKey FKTJKMMVZTUAQE-UHFFFAOYSA-N
Molecular Weight 331.821 g/mol
SMILES Nc1c(C#N)c(sc1C(c1ccc(cc1)Cl)=O)N1CCCC1
SPLASH splash10-001i-0209000000-cc21b4147c14721fdb2d
Source of Spectrum F-65-10457-16
Wiley ID 1678579