SpectraBase Spectrum ID |
3NyMc2ZUVux |
Name |
1-Methylthio-2,3-(bis-endo-diacetyl)bicyclo[2.2.1]hept-5-ene |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H16O2S |
InChI |
InChI=1S/C12H16O2S/c1-7(13)10-9-4-5-12(6-9,15-3)11(10)8(2)14/h4-5,9-11H,6H2,1-3H3/t9-,10-,11+,12-/m0/s1 |
InChIKey |
PXMQAXARRMASLB-YFKTTZPYSA-N |
Molecular Weight |
224.318 g/mol |
SMILES |
[C@]12([C@@]([C@@](C(=O)C)([C@](C2)(C=C1)[H])[H])(C(=O)C)[H])SC |
SPLASH |
splash10-001i-0950000000-5545abd04fa3d25e9d15 |
Source of Spectrum |
QA-43-294-11 |
Wiley ID |
862286 |