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(5R,7R)-6,6-dimethyl-2,3-di(pyridin-2-yl)-5,6,7,8-tetrahydro-5,7-methanoquinoxaline
SpectraBase Compound ID J1DLrGUjLjH
InChI InChI=1S/C21H20N4/c1-21(2)13-11-14(21)18-17(12-13)24-19(15-7-3-5-9-22-15)20(25-18)16-8-4-6-10-23-16/h3-10,13-14H,11-12H2,1-2H3/t13-,14+/m1/s1
InChIKey OGJIUPJFKWCQIL-KGLIPLIRSA-N
Mol Weight 328.42 g/mol
Molecular Formula C21H20N4
Exact Mass 328.168797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9jweXiImds
Name (5R,7R)-6,6-dimethyl-2,3-di(pyridin-2-yl)-5,6,7,8-tetrahydro-5,7-methanoquinoxaline
Appearance Off-white solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N4
InChI InChI=1S/C21H20N4/c1-21(2)13-11-14(21)18-17(12-13)24-19(15-7-3-5-9-22-15)20(25-18)16-8-4-6-10-23-16/h3-10,13-14H,11-12H2,1-2H3/t13-,14+/m1/s1
InChIKey OGJIUPJFKWCQIL-KGLIPLIRSA-N
Instrument Name Agilent Technologies 6890N-5973 Network
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.226
Molecular Weight 328.419 g/mol
Optical Rotation [a]D20 = +12.6 (c = 0.5, CH3OH)
SMILES C1([C@]2(C[C@@]1(Cc1nc(c(nc21)-c1ccccn1)-c1ccccn1)[H])[H])(C)C
SPLASH splash10-004r-1298000000-0fefd1092c2796b71480
Source of Spectrum ARK-2010-320-2b
Thin-Layer Chromatography Rf = 0.21 (SiO2, Hexane/EtOAc, 2:1)
Wiley ID 1869979