SpectraBase Spectrum ID |
E96QdutGWq1 |
Name |
diendo-4-Phenyl-6-p-tolyl-4,5-diaza-tricyclo[6.2.1.0(2,7)]undec-5-en-3-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H22N2O |
InChI |
InChI=1S/C22H22N2O/c1-14-7-9-15(10-8-14)21-19-16-11-12-17(13-16)20(19)22(25)24(23-21)18-5-3-2-4-6-18/h2-10,16-17,19-20H,11-13H2,1H3/t16-,17+,19+,20-/m0/s1 |
InChIKey |
SHTPJOXUWSSTHE-CUDHKJQZSA-N |
Instrument Name |
VG Analytical MM 7070E |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/rcm.1290081223 |
Molecular Weight |
330.431 g/mol |
SMILES |
C1[C@]2(C[C@@](C1)([C@]1([C@@]2(C(=NN(C1=O)c1ccccc1)c1ccc(cc1)C)[H])[H])[H])[H] |
SPLASH |
splash10-001i-0019000000-a2130757917afdd67c37 |
Source of Spectrum |
RCM-8-1022-10 |
Wiley ID |
1835623 |