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diendo-6-p-Tolyl-4,5-diaza-t ricyclo[6.2.1.0(2,7)]undec-5-en-3-o ne
SpectraBase Compound ID 3yg0Om4w3N3
InChI InChI=1S/C16H18N2O/c1-9-2-4-10(5-3-9)15-13-11-6-7-12(8-11)14(13)16(19)18-17-15/h2-5,11-14H,6-8H2,1H3,(H,18,19)/t11-,12+,13+,14-/m0/s1
InChIKey PTOMBHMOSXDPCR-DGAVXFQQSA-N
Mol Weight 254.33 g/mol
Molecular Formula C16H18N2O
Exact Mass 254.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L47lx0u2735
Name diendo-6-p-Tolyl-4,5-diaza-t ricyclo[6.2.1.0(2,7)]undec-5-en-3-o ne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O
InChI InChI=1S/C16H18N2O/c1-9-2-4-10(5-3-9)15-13-11-6-7-12(8-11)14(13)16(19)18-17-15/h2-5,11-14H,6-8H2,1H3,(H,18,19)/t11-,12+,13+,14-/m0/s1
InChIKey PTOMBHMOSXDPCR-DGAVXFQQSA-N
Instrument Name VG Analytical MM 7070E
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290081223
Molecular Weight 254.333 g/mol
SMILES N1N=C([C@@]2([C@@]3(C[C@]([C@@]2(C1=O)[H])(CC3)[H])[H])[H])c1ccc(cc1)C
SPLASH splash10-0udr-3980000000-06ffc14ffc2b9148d772
Source of Spectrum RCM-8-1022-5
Wiley ID 1835630