| SpectraBase Spectrum ID |
48Uw3aL5c2t |
| Name |
Encecalin |
| CAS Registry Number |
20628-09-5 |
| 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 |
232.109944372 u |
| Formula |
C14H16O3 |
| InChI |
InChI=1S/C14H16O3/c1-9(15)11-7-10-5-6-14(2,3)17-12(10)8-13(11)16-4/h5-8H,1-4H3 |
| InChIKey |
WXVLCNREBFDEKS-UHFFFAOYSA-N |
| Molecular Weight |
232.279 g/mol |
| Number of Peaks |
50 |
| RI1 |
1868 |
| SMILES |
c1(cc2C=CC(Oc2cc1OC)(C)C)C(=O)C |
| SPLASH |
splash10-014i-1390000000-4471e8976f6f5bd585dd |
| 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 |
Ethanone, 1-(7-methoxy-2,2-dimethyl-2H-1-benzopyran-6-yl)- |
| Wiley ID |
LM_FFNSC3_2702 |
