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6-chloranylpyrrolo[2,1-c][1,4]benzodiazepin-11-one
SpectraBase Compound ID B37ZJSqwpbh
InChI InChI=1S/C12H7ClN2O/c13-11-10-6-3-7-15(10)12(16)8-4-1-2-5-9(8)14-11/h1-7H
InChIKey DDBWWAJCDQGQLF-UHFFFAOYSA-N
Mol Weight 230.65 g/mol
Molecular Formula C12H7ClN2O
Exact Mass 230.024691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBm8Du08EhG
Name 6-chloranylpyrrolo[2,1-c][1,4]benzodiazepin-11-one
Alternate Name(s) 6-chloro-11-pyrrolo[2,1-c][1,4]benzodiazepinone 6-chloropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H7ClN2O
InChI InChI=1S/C12H7ClN2O/c13-11-10-6-3-7-15(10)12(16)8-4-1-2-5-9(8)14-11/h1-7H
InChIKey DDBWWAJCDQGQLF-UHFFFAOYSA-N
Molecular Weight 230.654 g/mol
SMILES C1([n]2c(C(=Nc3c1cccc3)Cl)ccc2)=O
SPLASH splash10-001i-0390000000-c1a1466e8459f0881551
Source of Spectrum AT-38-2273-6
Wiley ID 853782