SpectraBase Spectrum ID |
Qpy5b42bGQ |
Name |
Methyl (5RS,6RS,7RS)-5-(Imidazol-2-ylthiocarbonyloxy)-1-azabicyclo[5.3.0]decane-6-carboxylate |
Alternate Name(s) |
Methyl 8-[(1H-imidazol-2-ylcarbothioyl)oxy]octahydro-1H-pyrrolo[1,2-a]azepine-9-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H21N3O3S |
InChI |
InChI=1S/C15H21N3O3S/c1-20-14(19)12-10-4-2-8-18(10)9-3-5-11(12)21-15(22)13-16-6-7-17-13/h6-7,10-12H,2-5,8-9H2,1H3,(H,16,17) |
InChIKey |
PQKQCYRHCBRABP-UHFFFAOYSA-N |
Molecular Weight |
323.411 g/mol |
SMILES |
[nH]1ccnc1C(OC1CCCN2C(C1C(=O)OC)CCC2)=S |
SPLASH |
splash10-001s-2900000000-5e3f68552f48e7f20de6 |
Source of Spectrum |
K1-2004-4232-73 |
Wiley ID |
1561659 |