| SpectraBase Spectrum ID |
KhP1lUHCLaC |
| Name |
(1R,2S,10R,11R)-5-thia-3,8-diazatetracyclo[9.2.1.0(2,10).0(4,8)]tetradeca-3,12-dien-9-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12N2OS |
| InChI |
InChI=1S/C11H12N2OS/c14-10-8-6-1-2-7(5-6)9(8)12-11-13(10)3-4-15-11/h1-2,6-9H,3-5H2/t6-,7+,8-,9+/m1/s1 |
| InChIKey |
UOJLXBAUURPUAR-XAVMHZPKSA-N |
| Instrument Name |
VG Analytical 7070E |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002_(SICI)1097-0231(199604)10_6_721 |
| Molecular Weight |
220.290 g/mol |
| SMILES |
C=1[C@]2(C[C@@](C1)([C@@]1([C@]2(N=C2N(C1=O)CCS2)[H])[H])[H])[H] |
| SPLASH |
splash10-0pvi-5900000000-cebec7fb328641728809 |
| Sample Comments |
Exo-isomer |
| Source of Spectrum |
RCM-10-722-9 |
| Wiley ID |
1836049 |
![(1R,2S,10R,11R)-5-thia-3,8-diazatetracyclo[9.2.1.0(2,10).0(4,8)]tetradeca-3,12-dien-9-one](/api/spectrum/KhP1lUHCLaC/structure.png?h=300&w=458 "(1R,2S,10R,11R)-5-thia-3,8-diazatetracyclo[9.2.1.0(2,10).0(4,8)]tetradeca-3,12-dien-9-one")
