| SpectraBase Spectrum ID |
1XWJ1DOUO8 |
| Name |
8-bromo-2,2,3a,5-tetramethyl-1,3,10,10a-tetrahydrocyclopenta[c][1]benzazepin-4-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22BrNO |
| InChI |
InChI=1S/C17H22BrNO/c1-16(2)9-12-7-11-8-13(18)5-6-14(11)19(4)15(20)17(12,3)10-16/h5-6,8,12H,7,9-10H2,1-4H3 |
| InChIKey |
HTORCWGKLSXROY-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Molecular Weight |
336.273 g/mol |
| Reported Formula |
C17H23BrNO |
| SMILES |
c1(cc2c(cc1)N(C(C1(C(C2)CC(C1)(C)C)C)=O)C)Br |
| SPLASH |
splash10-00y1-0953000000-a16c1b5262f21c289451 |
| Sample Comments |
dr = 3:2 |
| Source of Spectrum |
CN111018784A |
| Wiley ID |
1877132 |
![8-bromo-2,2,3a,5-tetramethyl-1,3,10,10a-tetrahydrocyclopenta[c][1]benzazepin-4-one](/api/spectrum/1XWJ1DOUO8/structure.png?h=300&w=458 "8-bromo-2,2,3a,5-tetramethyl-1,3,10,10a-tetrahydrocyclopenta[c][1]benzazepin-4-one")
