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1H-Isoindole-1,3(2H)-dione, 2-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]-
SpectraBase Compound ID 1BDTZIJaYJ8
InChI InChI=1S/C14H12N4O4/c1-9-15-8-12(18(21)22)16(9)6-7-17-13(19)10-4-2-3-5-11(10)14(17)20/h2-5,8H,6-7H2,1H3
InChIKey JIYZWSLKPBBNTE-UHFFFAOYSA-N
Mol Weight 300.27 g/mol
Molecular Formula C14H12N4O4
Exact Mass 300.085855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5URLZEPvzBp
Name 1H-Isoindole-1,3(2H)-dione, 2-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O4
InChI InChI=1S/C14H12N4O4/c1-9-15-8-12(18(21)22)16(9)6-7-17-13(19)10-4-2-3-5-11(10)14(17)20/h2-5,8H,6-7H2,1H3
InChIKey JIYZWSLKPBBNTE-UHFFFAOYSA-N
Molecular Weight 300.274 g/mol
SMILES c1([n](c(C)nc1)CCN1C(c2ccccc2C1=O)=O)N(=O)=O
SPLASH splash10-0w4i-8920000000-a3e35ddaf381c962e547
Source of Spectrum IY-1-4586-7
Synonyms 2-[2-(2-methyl-5-nitro-1-imidazolyl)ethyl]isoindole-1,3-dione 2-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]isoindole-1,3-dione 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]isoindoline-1,3-dione 2-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]isoindole-1,3-dione
Wiley ID 1653850