| SpectraBase Spectrum ID |
EpmWFruxDCA |
| Name |
Iridolactone |
| CAS Registry Number |
128657-97-6 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
168.115029753 u |
| Formula |
C10H16O2 |
| InChI |
InChI=1S/C10H16O2/c1-6-3-4-8-7(2)10(11)12-5-9(6)8/h6-9H,3-5H2,1-2H3/t6-,7-,8-,9-/m0/s1 |
| InChIKey |
LYEFRAMOOLOUKA-JBDRJPRFSA-N |
| Molecular Weight |
168.236 g/mol |
| Number of Peaks |
48 |
| RI1 |
1446 |
| SMILES |
[C@@]12([C@@](COC([C@]2(C)[H])=O)([C@@](C)(CC1)[H])[H])[H] |
| SPLASH |
splash10-0159-9000000000-80d2c06ccce07f60965a |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Cyclopenta(c)pyran-3(1H)-one, hexahydro-4,7-dimethyl- |
| Wiley ID |
LM_FFNSC3_2189 |
![Cyclopenta[c]pyran-3(1H)-one, hexahydro-4,7-dimethyl-, (4.alpha.,4a.alpha.,7.beta.,7a.alpha.)-(.+-.)-](/api/spectrum/EpmWFruxDCA/structure.png?h=300&w=458 "Cyclopenta[c]pyran-3(1H)-one, hexahydro-4,7-dimethyl-, (4.alpha.,4a.alpha.,7.beta.,7a.alpha.)-(.+-.)-")
