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1H-Indole, 1-(5-nitropentyl)-
SpectraBase Compound ID 4YBZGYC0w6J
InChI InChI=1S/C13H16N2O2/c16-15(17)10-5-1-4-9-14-11-8-12-6-2-3-7-13(12)14/h2-3,6-8,11H,1,4-5,9-10H2
InChIKey QXOGXIVDFKWBQU-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C13H16N2O2
Exact Mass 232.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LkxQo65jeKt
Name 1H-Indole, 1-(5-nitropentyl)-
CAS Registry Number 131322-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O2
InChI InChI=1S/C13H16N2O2/c16-15(17)10-5-1-4-9-14-11-8-12-6-2-3-7-13(12)14/h2-3,6-8,11H,1,4-5,9-10H2
InChIKey QXOGXIVDFKWBQU-UHFFFAOYSA-N
Molecular Weight 232.283 g/mol
SMILES c1ccc2c(c1)cc[n]2CCCCCN(=O)=O
SPLASH splash10-001i-0960000000-4c9c2851bdb89533e197
Source of Spectrum J-56-899-5
Synonyms 1-(5-Nitropentyl)-1H-indole 1-(5-Nitropentyl)indole
Wiley ID 1233819