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(E/Z)-2,2-Dimethyl-5-[(3,4-methylendioxyphenyl)ethenyl]-2H-benzimidazole 1,3-dioxide
SpectraBase Compound ID WCgbitapHO
InChI InChI=1S/C18H16N2O4/c1-18(2)19(21)14-7-5-12(9-15(14)20(18)22)3-4-13-6-8-16-17(10-13)24-11-23-16/h3-10H,11H2,1-2H3/b4-3+
InChIKey QHXQDQPWNZHUIF-ONEGZZNKSA-N
Mol Weight 324.34 g/mol
Molecular Formula C18H16N2O4
Exact Mass 324.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xX9nafcADM
Name (E/Z)-2,2-Dimethyl-5-[(3,4-methylendioxyphenyl)ethenyl]-2H-benzimidazole 1,3-dioxide
Alternate Name(s) 5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-2,2-dimethyl-3-oxidobenzimidazol-1-ium 1-oxide 5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-2,2-dimethyl-3-oxidanidyl-benzimidazol-1-ium 1-oxide
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Formula C18H16N2O4
InChI InChI=1S/C18H16N2O4/c1-18(2)19(21)14-7-5-12(9-15(14)20(18)22)3-4-13-6-8-16-17(10-13)24-11-23-16/h3-10H,11H2,1-2H3/b4-3+
InChIKey QHXQDQPWNZHUIF-ONEGZZNKSA-N
Molecular Weight 324.336 g/mol
SMILES C1([N+](=C2C(=[N+]1[O-])C=CC(=C2)\C=C\c1cc2OCOc2cc1)[O-])(C)C
SPLASH splash10-054o-0096000000-44b55dc9eb302bfe12f1
Source of Spectrum F2-44-4430-11
Wiley ID 1705720