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4-Propanoyl-4H-1,4-benzothiazine-2-carbonitrile
SpectraBase Compound ID 58eiEZJ9teV
InChI InChI=1S/C12H10N2OS/c1-2-12(15)14-8-9(7-13)16-11-6-4-3-5-10(11)14/h3-6,8H,2H2,1H3
InChIKey ZKFZXLHGRBXNKA-UHFFFAOYSA-N
Mol Weight 230.28 g/mol
Molecular Formula C12H10N2OS
Exact Mass 230.051384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XmeSN73KCp
Name 4-Propanoyl-4H-1,4-benzothiazine-2-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C12H10N2OS
InChI InChI=1S/C12H10N2OS/c1-2-12(15)14-8-9(7-13)16-11-6-4-3-5-10(11)14/h3-6,8H,2H2,1H3
InChIKey ZKFZXLHGRBXNKA-UHFFFAOYSA-N
Molecular Weight 230.285 g/mol
SMILES C=1(Sc2c(N(C1)C(CC)=O)cccc2)C#N
SPLASH splash10-00di-0900000000-ea4c6dc7c156177f6730
Source of Spectrum SO-0-1080-2
Synonyms 4-propionyl-4H-1,4-benzothiazine-2-carbonitrile
Wiley ID 1611982