| SpectraBase Spectrum ID |
XGDmKw9Vus |
| Name |
(9aR*,3S*,2aS*,9bS*)-5a-aza-2,2a,3,5,6,7,8,9,9a,9b-decahydro-5-oxo-4-oxa-3-phenyl-1H-benz[c,d]azulene |
| CAS Registry Number |
124944-01-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21NO2 |
| InChI |
InChI=1S/C17H21NO2/c19-17-18-11-5-4-6-12-9-10-14(15(12)18)16(20-17)13-7-2-1-3-8-13/h1-3,7-8,12,14-16H,4-6,9-11H2/t12-,14+,15+,16-/m1/s1 |
| InChIKey |
NRXVZCOZMBYFJM-SYAUCNOPSA-N |
| Molecular Weight |
271.360 g/mol |
| SMILES |
C1(N2[C@]3([C@@](CC[C@@]3([C@](O1)(c1ccccc1)[H])[H])(CCCC2)[H])[H])=O |
| SPLASH |
splash10-004i-0090000000-71470880dbe8ae48c50e |
| Source of Spectrum |
J-55-1457-75 |
| Synonyms |
(3R*,2aS*,9bS*)-5a-aza-2,2a,3,5,6,7,8,8,8a,9b-decahydro-5-oxo-4-oxa-3-phenyl-1H-benz[c,d]azulene
(2aS,3S,9aR,9bS)-3-phenyldecahydro-4-oxa-5a-azabenzo[cd]azulen-5-one |
| Wiley ID |
1275437 |
![(9aR*,3S*,2aS*,9bS*)-5a-aza-2,2a,3,5,6,7,8,9,9a,9b-decahydro-5-oxo-4-oxa-3-phenyl-1H-benz[c,d]azulene](/api/spectrum/XGDmKw9Vus/structure.png?h=300&w=458 "(9aR*,3S*,2aS*,9bS*)-5a-aza-2,2a,3,5,6,7,8,9,9a,9b-decahydro-5-oxo-4-oxa-3-phenyl-1H-benz[c,d]azulene")
