SpectraBase Spectrum ID |
94PBXCiffC9 |
Name |
Conglomerone |
CAS Registry Number |
480-25-1 |
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 |
238.120509056 u |
Formula |
C13H18O4 |
InChI |
InChI=1S/C13H18O4/c1-8(2)13(14)12-10(16-4)6-9(15-3)7-11(12)17-5/h6-8H,1-5H3 |
InChIKey |
SFPOBVXEFQAMIK-UHFFFAOYSA-N |
Molecular Weight |
238.283 g/mol |
Number of Peaks |
50 |
RI1 |
1806 |
SMILES |
c1(C(C(C)C)=O)c(cc(cc1OC)OC)OC |
SPLASH |
splash10-0002-1900000000-4087bf3cc9ee5f258e93 |
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 |
1-Propanone, 2-methyl-1-(2,4,6-trimethoxyphenyl)- |
Wiley ID |
LM_FFNSC3_2959 |