| SpectraBase Spectrum ID |
CmFd0hPvzdf |
| Name |
Callistrin |
| CAS Registry Number |
72523-74-1 |
| 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 |
234.161979946 u |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h10-13H,1,4-8H2,2-3H3/t10-,11-,12-,13-,15+/m1/s1 |
| InChIKey |
YYJRTJYCOMIDIC-HVNMYJMUSA-N |
| Molecular Weight |
234.339 g/mol |
| Number of Peaks |
50 |
| RI1 |
1970 |
| SMILES |
C1C[C@]2(C[C@@]3([C@](C[C@@]2(C(C1)=C)[H])([C@](C(O3)=O)(C)[H])[H])[H])C |
| SPLASH |
splash10-053u-8910000000-6e0a8173d0cba8b5f651 |
| 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 |
Naphtho[2,3-b]furan-2(3H)-one, decahydro-3,8a-dimethyl-5-methylene- |
| Wiley ID |
LM_FFNSC3_2505 |
![(3R,3aR,4aR,8aS,9aR)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one](/api/spectrum/CmFd0hPvzdf/structure.png?h=300&w=458 "(3R,3aR,4aR,8aS,9aR)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one")
