| SpectraBase Spectrum ID |
1aRc5sKmpkK |
| Name |
1,4-Dithiaspiro[4.5]decane-6-carboxylic acid, 9-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-, methyl ester, [trans[trans(trans)]]- |
| CAS Registry Number |
101630-59-5 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H42O2S2 |
| InChI |
InChI=1S/C25H42O2S2/c1-3-4-18-5-7-19(8-6-18)20-9-11-21(12-10-20)22-13-14-23(24(26)27-2)25(17-22)28-15-16-29-25/h18-23H,3-17H2,1-2H3/t18?,19?,20-,21?,22-,23+/m1/s1 |
| InChIKey |
OUMGVHUMYQMDQD-AAZVDIAPSA-N |
| Molecular Weight |
438.729 g/mol |
| SMILES |
C12([C@](C(=O)OC)(CC[C@](C2)(C2CCC(CC2)C2CCC(CC2)CCC)[H])[H])SCCS1 |
| SPLASH |
splash10-001i-0090400000-346cb99f13b08ab39747 |
| Source of Spectrum |
K-119-396-14 |
| Synonyms |
methyl (6S,9R)-9-[4-(4-propylcyclohexyl)cyclohexyl]-1,4-dithiaspiro[4.5]decane-6-carboxylate
Methyl 2,2-(ethylenedithio)trans-4-[trans-4-(trans-4-propylcyclohexyl)cyclohexyl]cyclohexane-carboxylate |
| Wiley ID |
1384189 |
![1,4-Dithiaspiro[4.5]decane-6-carboxylic acid, 9-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-, methyl ester, [trans[trans(trans)]]-](/api/spectrum/1aRc5sKmpkK/structure.png?h=300&w=458 "1,4-Dithiaspiro[4.5]decane-6-carboxylic acid, 9-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-, methyl ester, [trans[trans(trans)]]-")
