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1-(4-Methylphenyl)-3,4-dihydro-5H-benzothieno[2,3-d][1,2]diazepin-4-one
SpectraBase Compound ID BIERBTcnyml
InChI InChI=1S/C18H14N2OS/c1-11-6-8-12(9-7-11)17-18-14(10-16(21)19-20-17)13-4-2-3-5-15(13)22-18/h2-9H,10H2,1H3,(H,19,21)
InChIKey CFAUTXASNCISCJ-UHFFFAOYSA-N
Mol Weight 306.38 g/mol
Molecular Formula C18H14N2OS
Exact Mass 306.082684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3TzKbjbKPE
Name 1-(4-Methylphenyl)-3,4-dihydro-5H-benzothieno[2,3-d][1,2]diazepin-4-one
Alternate Name(s) 1-(p-tolyl)-3H-benzo[4,5]thieno[2,3-d][1,2]diazepin-4(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N2OS
InChI InChI=1S/C18H14N2OS/c1-11-6-8-12(9-7-11)17-18-14(10-16(21)19-20-17)13-4-2-3-5-15(13)22-18/h2-9H,10H2,1H3,(H,19,21)
InChIKey CFAUTXASNCISCJ-UHFFFAOYSA-N
Molecular Weight 306.383 g/mol
SMILES N1C(Cc2c(C(=N1)c1ccc(cc1)C)sc1ccccc21)=O
SPLASH splash10-0a6r-1389000000-2455920f6e296864d864
Source of Spectrum HC-48-1378-15b
Wiley ID 1739606