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4H-Pyrrolo[2,1-c][1,4]benzothiazine, methanone deriv.
SpectraBase Compound ID 8YSRsUFD5pZ
InChI InChI=1S/C18H13NOS/c20-18(13-6-2-1-3-7-13)14-10-11-19-15-8-4-5-9-17(15)21-12-16(14)19/h1-10,12H,11H2
InChIKey NCVRQESTXJHYLX-UHFFFAOYSA-N
Mol Weight 291.37 g/mol
Molecular Formula C18H13NOS
Exact Mass 291.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lg3jeE0zKX
Name 4H-Pyrrolo[2,1-c][1,4]benzothiazine, methanone deriv.
Alternate Name(s) Methanone, phenyl-4H-pyrrolo[2,1-c][1,4]benzothiazin-4-yl- 3-Phenylcarbonyl-pyrrolo[2.1-c][1.4]benzothiazine phenyl(1H-pyrrolo[2,1-c][1,4]benzothiazin-3-yl)methanone
CAS Registry Number 107344-62-7
Comments Less than 3 mono-isotopic peaks
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Formula C18H13NOS
InChI InChI=1S/C18H13NOS/c20-18(13-6-2-1-3-7-13)14-10-11-19-15-8-4-5-9-17(15)21-12-16(14)19/h1-10,12H,11H2
InChIKey NCVRQESTXJHYLX-UHFFFAOYSA-N
Molecular Weight 291.368 g/mol
SMILES C=12C(=CCN2c2ccccc2SC1)C(=O)c1ccccc1
SPLASH splash10-000i-0900000000-25423d0701fba8a7d196
Source of Spectrum Y-23-698-0
Wiley ID 1294679