| SpectraBase Spectrum ID |
1Wwz0UX5FTW |
| Name |
2,6-Methano-2H-1,3-benzoxazocine-5-carbonitrile, 3,4,5,6-tetrahydro-2-methyl-4-oxo-, (2.alpha.,5.beta.,6.alpha.)- |
| CAS Registry Number |
118733-91-8 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H12N2O2 |
| InChI |
InChI=1S/C13H12N2O2/c1-13-6-9(10(7-14)12(16)15-13)8-4-2-3-5-11(8)17-13/h2-5,9-10H,6H2,1H3,(H,15,16)/t9-,10-,13-/m0/s1 |
| InChIKey |
LEHJKPZIVDYYAU-KWBADKCTSA-N |
| Molecular Weight |
228.251 g/mol |
| SMILES |
N1[C@@]2(C[C@]([C@@](C1=O)(C#N)[H])(c1ccccc1O2)[H])C |
| SPLASH |
splash10-002u-4930000000-cd091dbacd7d94a50639 |
| Source of Spectrum |
KC-1988-2056-7 |
| Synonyms |
(1R,9S,12R)-9-methyl-11-oxo-8-oxa-10-azatricyclo[7.3.1.0(2,7)]trideca-2,4,6-triene-12-carbonitrile
9-Methyl-11-oxo-8-oxa-10-azatricyclo[7.3.1.0(2,7)]trideca-2,4,6-triena-12-carbonitrile |
| Wiley ID |
1229684 |
