![(1 R / S)-1-Formyl-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane](/api/spectrum/CA2t27WjoY7/structure.png?h=300&w=458 "(1 R / S)-1-Formyl-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane")
| SpectraBase Compound ID | 9R69md67WDJ |
|---|---|
| InChI | InChI=1S/C14H22O2S2/c1-12-5-6-14(17-7-2-8-18-14)10-13(12,16)4-3-11(12)9-15/h9,11,16H,2-8,10H2,1H3/t11-,12-,13+/m1/s1 |
| InChIKey | YGJRVMGGDPDHKX-UPJWGTAASA-N |
| Mol Weight | 286.45 g/mol |
| Molecular Formula | C14H22O2S2 |
| Exact Mass | 286.106122 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CA2t27WjoY7 |
|---|---|
| Name | (1 R / S)-1-Formyl-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H22O2S2 |
| InChI | InChI=1S/C14H22O2S2/c1-12-5-6-14(17-7-2-8-18-14)10-13(12,16)4-3-11(12)9-15/h9,11,16H,2-8,10H2,1H3/t11-,12-,13+/m1/s1 |
| InChIKey | YGJRVMGGDPDHKX-UPJWGTAASA-N |
| Molecular Weight | 286.448 g/mol |
| SMILES | O[C@@]12[C@](CCC3(C2)SCCCS3)([C@@](C=O)(CC1)[H])C |
| SPLASH | splash10-000j-4590000000-8004701345352bea6aee |
| Source of Spectrum | Y4-91-93-6 |
| Synonyms | (1 S / R)-1-Formyl-3a-hydroxy-7a-methyl-5-spiro[2'-(1'',3'-dithiacyclohexano)]bicyclo[4.3.0]nonane (1S,3aS,7aR)-3a-hydroxy-7a-methyl-1-spiro[1,2,3,4,6,7-hexahydroindene-5,2'-1,3-dithiane]carboxaldehyde (1S,3aS,7aR)-3a-hydroxy-7a-methylspiro[1,2,3,4,6,7-hexahydroindene-5,2'-1,3-dithiane]-1-carbaldehyde (1S,3aS,7aR)-7a-methyl-3a-oxidanyl-spiro[1,2,3,4,6,7-hexahydroindene-5,2'-1,3-dithiane]-1-carbaldehyde |
| Wiley ID | 840663 |