SpectraBase Spectrum ID |
6yZ5xycqJLR |
Name |
Diosphenol |
CAS Registry Number |
490-03-9 |
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(2)8-5-4-7(3)9(11)10(8)12/h6,8,11H,4-5H2,1-3H3 |
InChIKey |
QSIMLPCPCXVYDD-UHFFFAOYSA-N |
Molecular Weight |
168.236 g/mol |
Number of Peaks |
50 |
RI1 |
1299 |
RI2 |
977 |
SMILES |
OC1=C(CCC(C1=O)C(C)C)C |
SPLASH |
splash10-056u-7900000000-d87cbf48ae751b0250be |
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, 2-hydroxy-3-methyl-6-(1-methylethyl)- |
Wiley ID |
LM_FFNSC3_1583 |