SpectraBase Spectrum ID |
3TcS6OOoYLT |
Name |
11-Azatriyclo[4.4.2.1(2,5)]trideca-3,7,9-trien-12-one |
Comments |
Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821096 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO |
InChI |
InChI=1S/C12H13NO/c14-12-10-3-1-2-4-11(13-12)9-6-5-8(10)7-9/h1-6,8-11H,7H2,(H,13,14)/b3-1-,4-2-/t8-,9-,10-,11+/m0/s1 |
InChIKey |
FPTONVBWXZBUQB-XBZOLAMBSA-N |
Molecular Weight |
187.242 g/mol |
SMILES |
N1[C@]2([C@]3(C=C[C@]([C@@](C1=O)(\C=C/C=C\2)[H])(C3)[H])[H])[H] |
SPLASH |
splash10-0012-9000000000-a3013091a2e16e24fb79 |
Source of Spectrum |
Y1-44-2642-8 |
Wiley ID |
1621445 |