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(1S,2R,10S,11R)-3-(4-methylphenyl)-4,8-diazatetracyclo[9.2.1.0(2,10).0(3,8)]tetradecan-9-one
SpectraBase Compound ID EwhAinQJXdz
InChI InChI=1S/C19H24N2O/c1-12-3-7-15(8-4-12)19-17-14-6-5-13(11-14)16(17)18(22)21(19)10-2-9-20-19/h3-4,7-8,13-14,16-17,20H,2,5-6,9-11H2,1H3/t13-,14+,16+,17-,19?/m1/s1
InChIKey PFJNRWQTKANKBB-SVILMNMMSA-N
Mol Weight 296.41 g/mol
Molecular Formula C19H24N2O
Exact Mass 296.188863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAevC7aPfGd
Name (1S,2R,10S,11R)-3-(4-methylphenyl)-4,8-diazatetracyclo[9.2.1.0(2,10).0(3,8)]tetradecan-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24N2O
InChI InChI=1S/C19H24N2O/c1-12-3-7-15(8-4-12)19-17-14-6-5-13(11-14)16(17)18(22)21(19)10-2-9-20-19/h3-4,7-8,13-14,16-17,20H,2,5-6,9-11H2,1H3/t13-,14+,16+,17-,19?/m1/s1
InChIKey PFJNRWQTKANKBB-SVILMNMMSA-N
Instrument Name VG Analytical MM 7070E
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290081013
Molecular Weight 296.414 g/mol
SMILES N1C2(N(CCC1)C([C@@]1([C@]2([C@]2(CC[C@@]1(C2)[H])[H])[H])[H])=O)c1ccc(cc1)C
SPLASH splash10-0600-2590000000-061c466ae90eb6556029
Sample Comments Diendo-isomer
Source of Spectrum RCM-8-860-6
Wiley ID 1835606