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3-(1-(3,4-dimethoxyphenyl)-2-nitroethyl)-1H-indole
SpectraBase Compound ID 8lgPx5jm7eI
InChI InChI=1S/C18H18N2O4/c1-23-17-8-7-12(9-18(17)24-2)15(11-20(21)22)14-10-19-16-6-4-3-5-13(14)16/h3-10,15,19H,11H2,1-2H3
InChIKey XKFRLOQNUVIGCC-UHFFFAOYSA-N
Mol Weight 326.35 g/mol
Molecular Formula C18H18N2O4
Exact Mass 326.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gpqet0zG4AZ
Name 3-(1-(3,4-dimethoxyphenyl)-2-nitroethyl)-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O4
InChI InChI=1S/C18H18N2O4/c1-23-17-8-7-12(9-18(17)24-2)15(11-20(21)22)14-10-19-16-6-4-3-5-13(14)16/h3-10,15,19H,11H2,1-2H3
InChIKey XKFRLOQNUVIGCC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.200800071
Molecular Weight 326.352 g/mol
SMILES [nH]1c2ccccc2c(c1)C(c1cc(c(cc1)OC)OC)C[N+](=O)[O-]
SPLASH splash10-00or-0093000000-01173df69420b76e2f6c
Source of Spectrum CAJ-3-1117-3j
Synonyms 3-[1-(3,4-dimethoxyphenyl)-2-nitroethyl]-1H-indole
Wiley ID 1774997