| SpectraBase Spectrum ID |
Dyyt9n0zw8w |
| Name |
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 |
C16H19NOS |
| InChI |
InChI=1S/C16H19NOS/c1-10(2)16(3)9-13-11-7-5-6-8-12(11)17(4)15(18)14(16)19-13/h5-8,13-14H,1,9H2,2-4H3/t13-,14+,16+/m0/s1 |
| InChIKey |
TUGPNKIHGDRQDC-SQWLQELKSA-N |
| Molecular Weight |
273.394 g/mol |
| SMILES |
[C@]12(C(N(c3ccccc3[C@@](S2)(C[C@@]1(C(=C)C)C)[H])C)=O)[H] |
| SPLASH |
splash10-03di-0920000000-863b0850bf3549c945ef |
| Source of Spectrum |
E1-45-268-9 |
| Wiley ID |
1553730 |
