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2-(4-(2,3,4-TETRAHYDRO-1-H-PYRIDO-[3.4-B]-INDOL-1-YL)-BUTYL)-ISOINDOLINE_1,3-DIONE
SpectraBase Compound ID CNcfUSQvvcz
InChI InChI=1S/C23H23N3O2/c27-22-17-8-1-2-9-18(17)23(28)26(22)14-6-5-11-20-21-16(12-13-24-20)15-7-3-4-10-19(15)25-21/h1-4,7-10,20,24-25H,5-6,11-14H2
InChIKey WBZAFUXBJDTNHN-UHFFFAOYSA-N
Mol Weight 373.46 g/mol
Molecular Formula C23H23N3O2
Exact Mass 373.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 282x69lw2A
Name 2-[4-(2,3,4,9-tetrahydro-1H-$b-carbolin-1-yl)butyl]isoindoline-1,3-quinone
Alternate Name(s) 2-[4-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)butyl]isoindole-1,3-dione 2-[4-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)butyl]isoindoline-1,3-dione
Comments Less than 3 mono-isotopic peaks
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Formula C23H23N3O2
InChI InChI=1S/C23H23N3O2/c27-22-17-8-1-2-9-18(17)23(28)26(22)14-6-5-11-20-21-16(12-13-24-20)15-7-3-4-10-19(15)25-21/h1-4,7-10,20,24-25H,5-6,11-14H2
InChIKey WBZAFUXBJDTNHN-UHFFFAOYSA-N
Molecular Weight 373.456 g/mol
SMILES [nH]1c2ccccc2c2c1C(CCCCN1C(c3ccccc3C1=O)=O)NCC2
SPLASH splash10-00di-0908000000-5717832e94612ee7622c
Source of Spectrum D8-328-375-16
Wiley ID 1515834