| SpectraBase Spectrum ID |
FwjiR0ShgkL |
| Name |
Damascone |
| CAS Registry Number |
57378-68-4 |
| 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 |
192.151415263 u |
| Formula |
C13H20O |
| InChI |
InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8,10,12H,9H2,1-4H3/b7-5+ |
| InChIKey |
XEJGJTYRUWUFFD-FNORWQNLSA-N |
| Molecular Weight |
192.302 g/mol |
| Number of Peaks |
50 |
| RI1 |
1375 |
| RI2 |
1053 |
| RI3 |
1162 |
| RI4 |
1121 |
| SMILES |
C1=CCC(C(C1C)C(\C=C\C)=O)(C)C |
| SPLASH |
splash10-014i-9300000000-b30c55645a757109d36d |
| 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-Buten-1-one, 1-(2,6,6-trimethyl-3-cyclohexen-1-yl)- |
| Wiley ID |
LM_FFNSC3_1305 |
