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2-(1,3-Benzodioxol-5-ylmethyl)-5-bromo-1H-isoindole-1,3(2H)-dione
SpectraBase Compound ID 6KIqNS8NjmJ
InChI InChI=1S/C16H10BrNO4/c17-10-2-3-11-12(6-10)16(20)18(15(11)19)7-9-1-4-13-14(5-9)22-8-21-13/h1-6H,7-8H2
InChIKey NBZGUKLXNIRSLB-UHFFFAOYSA-N
Mol Weight 360.16 g/mol
Molecular Formula C16H10BrNO4
Exact Mass 358.979321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mci37KyOS2
Name 2-(1,3-Benzodioxol-5-ylmethyl)-5-bromo-1H-isoindole-1,3(2H)-dione
Alternate Name(s) 2-(1,3-benzodioxol-5-ylmethyl)-5-bromanyl-isoindole-1,3-dione 2-(1,3-benzodioxol-5-ylmethyl)-5-bromo-isoindoline-1,3-dione 2-(1,3-benzodioxol-5-ylmethyl)-5-bromoisoindole-1,3-dione 5-Bromo-2-piperonyl-isoindoline-1,3-quinone
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Formula C16H10BrNO4
InChI InChI=1S/C16H10BrNO4/c17-10-2-3-11-12(6-10)16(20)18(15(11)19)7-9-1-4-13-14(5-9)22-8-21-13/h1-6H,7-8H2
InChIKey NBZGUKLXNIRSLB-UHFFFAOYSA-N
Molecular Weight 360.163 g/mol
SMILES c1cc2OCOc2cc1CN1C(c2cc(Br)ccc2C1=O)=O
SPLASH splash10-08fr-3936000000-05f9a4317c6e80fa7fa2
Wiley ID 1450949