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3-(Bis(1-methyl-1H-indol-3-yl)methyl)-2-butoxy-8-methylquinoline
SpectraBase Compound ID Dffdi7uyWaj
InChI InChI=1S/C33H33N3O/c1-5-6-18-37-33-26(19-23-13-11-12-22(2)32(23)34-33)31(27-20-35(3)29-16-9-7-14-24(27)29)28-21-36(4)30-17-10-8-15-25(28)30/h7-17,19-21,31H,5-6,18H2,1-4H3
InChIKey NXWWRTYLLNFNGY-UHFFFAOYSA-N
Mol Weight 487.6 g/mol
Molecular Formula C33H33N3O
Exact Mass 487.262363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPAHVbagMsQ
Name 3-(Bis(1-methyl-1H-indol-3-yl)methyl)-2-butoxy-8-methylquinoline
Appearance Red solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H33N3O
InChI InChI=1S/C33H33N3O/c1-5-6-18-37-33-26(19-23-13-11-12-22(2)32(23)34-33)31(27-20-35(3)29-16-9-7-14-24(27)29)28-21-36(4)30-17-10-8-15-25(28)30/h7-17,19-21,31H,5-6,18H2,1-4H3
InChIKey NXWWRTYLLNFNGY-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.15.60
Molecular Weight 487.647 g/mol
SMILES C(c1c[n](c2c1cccc2)C)(c1c[n](c2c1cccc2)C)c1c(nc2c(c1)cccc2C)OCCCC
SPLASH splash10-052f-9100200000-d3d1a4b1911d37d23e67
Source of Spectrum BJO-15-SM2-8{4,4,2}
Thin-Layer Chromatography Rf = 0.80 (30% EtOAc in hexane)
Wiley ID 1841017