| SpectraBase Spectrum ID |
JlqkgBXpMMb |
| Name |
(3aS,4S,5R,6aR,10aS,10bR)-6-Benzyl-4-methoxy-2,2,5-trimethyl-decahydro-1,3-dioxa-6-aza-benzo[e]azulene |
| Alternate Name(s) |
N-Benzyl-(2S,3S,4S,5R,5aR,9aS)-4,5-O-isopropylidene-2-methyl-3-methoxy-5a,9a-decahydro-1H-benzo[b]azepine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H33NO3 |
| InChI |
InChI=1S/C22H33NO3/c1-15-19(24-4)21-20(25-22(2,3)26-21)17-12-8-9-13-18(17)23(15)14-16-10-6-5-7-11-16/h5-7,10-11,15,17-21H,8-9,12-14H2,1-4H3/t15-,17+,18-,19+,20-,21-/m1/s1 |
| InChIKey |
BKKXGIMPELMKIW-MTNDGHDBSA-N |
| Molecular Weight |
359.510 g/mol |
| SMILES |
[C@]12(N([C@@]([C@@]([C@]3(OC(O[C@@]3([C@]2(CCCC1)[H])[H])(C)C)[H])(OC)[H])(C)[H])Cc1ccccc1)[H] |
| SPLASH |
splash10-002f-9008000000-ae3365399a626e074e49 |
| Source of Spectrum |
J-73-5297-61 |
| Wiley ID |
1668408 |
![(3aS,4S,5R,6aR,10aS,10bR)-6-Benzyl-4-methoxy-2,2,5-trimethyl-decahydro-1,3-dioxa-6-aza-benzo[e]azulene](/api/spectrum/JlqkgBXpMMb/structure.png?h=300&w=458 "(3aS,4S,5R,6aR,10aS,10bR)-6-Benzyl-4-methoxy-2,2,5-trimethyl-decahydro-1,3-dioxa-6-aza-benzo[e]azulene")
