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Propionitrile, 3-(2,3,3a,4,5,6(1H)-hexahydro-8-tert-butyl-cyclopenta[d,E][3,11]-phenanthrolin-3-yl)-
SpectraBase Compound ID Ik20PQWub2h
InChI InChI=1S/C21H27N3/c1-21(2,3)17-6-8-18-16(14-17)13-15-5-7-19-20(15)24(18)12-11-23(19)10-4-9-22/h6,8,14,19H,4-5,7,10-13H2,1-3H3
InChIKey ULOPUYGWMQWMGL-UHFFFAOYSA-N
Mol Weight 321.47 g/mol
Molecular Formula C21H27N3
Exact Mass 321.220498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cm6PLLdbVF4
Name Propionitrile, 3-(2,3,3a,4,5,6(1H)-hexahydro-8-tert-butyl-cyclopenta[d,E][3,11]-phenanthrolin-3-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27N3
InChI InChI=1S/C21H27N3/c1-21(2,3)17-6-8-18-16(14-17)13-15-5-7-19-20(15)24(18)12-11-23(19)10-4-9-22/h6,8,14,19H,4-5,7,10-13H2,1-3H3
InChIKey ULOPUYGWMQWMGL-UHFFFAOYSA-N
Molecular Weight 321.468 g/mol
SMILES c12ccc(cc2CC2=C3N1CCN(C3CC2)CCC#N)C(C)(C)C
SPLASH splash10-0006-1391000000-cdc12fab65d7799a3854
Source of Spectrum AD-0-2532-0
Wiley ID 1426684