SpectraBase Spectrum ID |
BxRzDof2wHQ |
Name |
3-Methoxycarbonyl-4-thia-5-butyl-4,4-dioxo-tetracyclo[5.2.1(1,7).0(2,6)]deca-8-ene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H22O4S |
InChI |
InChI=1S/C15H22O4S/c1-3-4-5-11-12-9-6-7-10(8-9)13(12)14(15(16)19-2)20(11,17)18/h6-7,9-14H,3-5,8H2,1-2H3/t9-,10-,11?,12-,13+,14?/m0/s1 |
InChIKey |
HQYRDMVKFQWWFA-GEIIMWPISA-N |
Molecular Weight |
298.397 g/mol |
SMILES |
C1(S(C([C@@]2([C@]3(C=C[C@]([C@@]12[H])(C3)[H])[H])[H])CCCC)(=O)=O)C(=O)OC |
SPLASH |
splash10-014i-9020000000-e09e6e6271c3eab42e79 |
Source of Spectrum |
F-42-4879-2 |
Synonyms |
Methyl 5-butyl-4-thiatricyclo[5.2.1.0(2,6)]dec-8-ene-3-carboxylate 4,4-dioxide |
Wiley ID |
1300731 |