SpectraBase Spectrum ID |
DSAl2olyPey |
Name |
5.beta.-Isobutyryl-9-methylthio-2-oxa-3-oxotricyclo[4.2.1.0(4,8)]nonane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H20O3S |
InChI |
InChI=1S/C14H20O3S/c1-6(2)4-9(15)10-8-5-7-11(10)14(16)17-12(7)13(8)18-3/h6-8,10-13H,4-5H2,1-3H3/t7-,8+,10-,11-,12+,13?/m0/s1 |
InChIKey |
XLSSIIRVLQAYAI-XAUBUPTRSA-N |
Molecular Weight |
268.371 g/mol |
SMILES |
C1([C@@]2([C@@]([C@@]3(C([C@](O1)([C@]2(C3)[H])[H])SC)[H])(C(CC(C)C)=O)[H])[H])=O |
SPLASH |
splash10-004i-0890000000-cb468395ae8f28ab5ee4 |
Source of Spectrum |
QA-43-286-6c |
Wiley ID |
862300 |