| SpectraBase Spectrum ID |
AWOwNojm42z |
| Name |
3-Ethyl-4-isopropenyl-1,4-dimethyl-3,4,5,6-tetrahydro-3,6-epothiobenzazocin-2(1H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H23NOS |
| InChI |
InChI=1S/C18H23NOS/c1-6-18-16(20)19(5)14-10-8-7-9-13(14)15(21-18)11-17(18,4)12(2)3/h7-10,15H,2,6,11H2,1,3-5H3/t15-,17+,18+/m0/s1 |
| InChIKey |
XVYFOEQVXLTNQO-CGTJXYLNSA-N |
| Molecular Weight |
301.448 g/mol |
| SMILES |
[C@]12(C(N(c3ccccc3[C@@](S2)(C[C@@]1(C(=C)C)C)[H])C)=O)CC |
| SPLASH |
splash10-000i-0904000000-2f8b3817dde0fb9e7600 |
| Source of Spectrum |
E1-45-269-12 |
| Wiley ID |
1553725 |
