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2-[2-(1,4-benzodioxin-3-yl)ethyl]isoindole-1,3-dione
SpectraBase Compound ID CDq0Y0QTR5n
InChI InChI=1S/C18H13NO4/c20-17-13-5-1-2-6-14(13)18(21)19(17)10-9-12-11-22-15-7-3-4-8-16(15)23-12/h1-8,11H,9-10H2
InChIKey FYSJFUBKOVSHTI-UHFFFAOYSA-N
Mol Weight 307.31 g/mol
Molecular Formula C18H13NO4
Exact Mass 307.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID g2lIRwYXfA
Name 2-[2-(1,4-benzodioxin-3-yl)ethyl]isoindole-1,3-dione
CAS Registry Number 128226-32-4
Comments Less than 3 mono-isotopic peaks
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Formula C18H13NO4
InChI InChI=1S/C18H13NO4/c20-17-13-5-1-2-6-14(13)18(21)19(17)10-9-12-11-22-15-7-3-4-8-16(15)23-12/h1-8,11H,9-10H2
InChIKey FYSJFUBKOVSHTI-UHFFFAOYSA-N
Molecular Weight 307.305 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCC=1Oc2ccccc2OC1)=O
SPLASH splash10-08fr-0905000000-128fb3afa4d9896c587a
Source of Spectrum F-46-931-0
Synonyms 2-[2-(1,4-benzodioxin-3-yl)ethyl]isoindoline-1,3-dione 2-[2-(1,4-benzodioxin-3-yl)ethyl]isoindoline-1,3-quinone
Wiley ID 1309004