| SpectraBase Spectrum ID |
2WnAgNmyrkc |
| Name |
Carvotanacetone <8-acetoxy-> |
| CAS Registry Number |
87578-93-6 |
| 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 |
210.125594437 u |
| Formula |
C12H18O3 |
| InChI |
InChI=1S/C12H18O3/c1-8-5-6-10(7-11(8)14)12(3,4)15-9(2)13/h5,10H,6-7H2,1-4H3/t10-/m1/s1 |
| InChIKey |
FTCAQUBXEGKQTD-SNVBAGLBSA-N |
| Molecular Weight |
210.273 g/mol |
| Number of Peaks |
50 |
| RI1 |
1571 |
| SMILES |
CC1=CC[C@](CC1=O)(C(OC(C)=O)(C)C)[H] |
| SPLASH |
splash10-052f-9400000000-2500ff8dcceb3497d945 |
| 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 |
2-cyclohexen-1-one,5-(1-(acetyloxy)-1-methylethyl)-2-methyl- |
| Wiley ID |
LM_FFNSC3_2553 |
