| SpectraBase Spectrum ID |
If73CnebwHi |
| Name |
2,2,3a-trimethyl-5-(p-tolylsulfonyl)-1,3,10,10a-tetrahydrocyclopenta[c][1]benzazepin-4-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27NO3S |
| InChI |
InChI=1S/C23H27NO3S/c1-16-9-11-19(12-10-16)28(26,27)24-20-8-6-5-7-17(20)13-18-14-22(2,3)15-23(18,4)21(24)25/h5-12,18H,13-15H2,1-4H3 |
| InChIKey |
BYXZUUDNOJPQJY-UHFFFAOYSA-N |
| Instrument Name |
LRMS |
| Ionization Type |
EI |
| Molecular Weight |
397.533 g/mol |
| Reported Formula |
C23H28NO3S |
| SMILES |
c1cc2c(cc1)N(C(C1(C(C2)CC(C1)(C)C)C)=O)S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-0a4i-0962000000-3786d14d06fe01a30088 |
| Sample Comments |
dr = 2:1 |
| Source of Spectrum |
CN111018784A |
| Wiley ID |
1877150 |
![2,2,3a-trimethyl-5-(p-tolylsulfonyl)-1,3,10,10a-tetrahydrocyclopenta[c][1]benzazepin-4-one](/api/spectrum/If73CnebwHi/structure.png?h=300&w=458 "2,2,3a-trimethyl-5-(p-tolylsulfonyl)-1,3,10,10a-tetrahydrocyclopenta[c][1]benzazepin-4-one")
