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4-(1H-indol-3-yl)-3-nitro-1-phenyl-pentan-1-one
SpectraBase Compound ID JiLYgo4516O
InChI InChI=1S/C19H18N2O3/c1-13(16-12-20-17-10-6-5-9-15(16)17)18(21(23)24)11-19(22)14-7-3-2-4-8-14/h2-10,12-13,18,20H,11H2,1H3
InChIKey VKBDYHGKSRUUFQ-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C19H18N2O3
Exact Mass 322.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tKkJ5WSA9C
Name 4-(1H-indol-3-yl)-3-nitro-1-phenyl-pentan-1-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2O3
InChI InChI=1S/C19H18N2O3/c1-13(16-12-20-17-10-6-5-9-15(16)17)18(21(23)24)11-19(22)14-7-3-2-4-8-14/h2-10,12-13,18,20H,11H2,1H3
InChIKey VKBDYHGKSRUUFQ-UHFFFAOYSA-N
Instrument Name Hewlett???Packard GC/MS 6890N
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100342
Molecular Weight 322.364 g/mol
SMILES [nH]1cc(c2c1cccc2)C(C)C([N+]([O-])=O)CC(c1ccccc1)=O
SPLASH splash10-05di-2950000000-cd2911fd527b4eecd38b
Source of Spectrum AJO-10-SM5-6a
Wiley ID 1866415