| SpectraBase Spectrum ID |
2LqmaWq6H0t |
| Name |
(7S)-7-Isobutyl-1-(p-tolylsulfonyl)-1,3,4,7-tetrahydroazepin-2-one |
| Alternate Name(s) |
(7S)-7-isobutyl-1-[(4-methylphenyl)sulfonyl]-1,3,4,7-tetrahydro-2H-azepin-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H23NO3S |
| InChI |
InChI=1S/C17H23NO3S/c1-13(2)12-15-6-4-5-7-17(19)18(15)22(20,21)16-10-8-14(3)9-11-16/h4,6,8-11,13,15H,5,7,12H2,1-3H3/t15-/m1/s1 |
| InChIKey |
ZDKNHPHWTJHDPQ-OAHLLOKOSA-N |
| Molecular Weight |
321.435 g/mol |
| SMILES |
[C@@]1(N(S(c2ccc(cc2)C)(=O)=O)C(CCC=C1)=O)(CC(C)C)[H] |
| SPLASH |
splash10-05fu-8669000000-8501f852f7f82a5a0d5d |
| Source of Spectrum |
KC-0-3404-24 |
| Wiley ID |
782789 |
