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Secofascaplysin

View entire compound with spectra: 2 MS (GC)

Secofascaplysin
SpectraBase Compound ID 2ZGOWY2vTEP
InChI InChI=1S/C19H14N2O3/c1-24-19(23)14-7-3-5-9-16(14)21-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-11,20H,1H3
InChIKey NTMHPHADSMMFRO-UHFFFAOYSA-N
Mol Weight 318.33 g/mol
Molecular Formula C19H14N2O3
Exact Mass 318.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwY9occnw6H
Name Secofascaplysin
Alternate Name(s) Secofascaplysin A 2-(1-Oxo-1,9-dihydro-.beta.-carbolin-2-yl)-benzoic acid methyl ester Methyl 2-(1-oxo-1,9-dihydro-2H-.beta.-carbolin-2-yl)benzoate 2-(1-oxo-9H-pyrido[3,4-b]indol-2-yl)benzoic acid methyl ester Methyl 2-(1-oxo-9H-pyrido[3,4-b]indol-2-yl)benzoate Methyl 2-(1-oxidanylidene-9H-pyrido[3,4-b]indol-2-yl)benzoate
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Formula C19H14N2O3
InChI InChI=1S/C19H14N2O3/c1-24-19(23)14-7-3-5-9-16(14)21-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-11,20H,1H3
InChIKey NTMHPHADSMMFRO-UHFFFAOYSA-N
Molecular Weight 318.332 g/mol
SMILES [nH]1c2ccccc2c2C=CN(C(c12)=O)c1c(C(=O)OC)cccc1
SPLASH splash10-0aor-0097000000-a636a6126ee4a894db73
Source of Spectrum F-52-7341-8
Wiley ID 796882