SpectraBase Spectrum ID |
CkHnVmqgUCN |
Name |
Butyroin |
Source of Sample |
SAFC Cat.no. S705500 |
CAS Registry Number |
496-77-5 |
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 |
144.115029753 u |
Formula |
C8H16O2 |
InChI |
InChI=1S/C8H16O2/c1-3-5-7(9)8(10)6-4-2/h7,9H,3-6H2,1-2H3 |
InChIKey |
BVEYJWQCMOVMAR-UHFFFAOYSA-N |
Molecular Weight |
144.214 g/mol |
Number of Peaks |
50 |
RI1 |
1072 |
RI2 |
745 |
RI3 |
961 |
RI4 |
916 |
RI5 |
1051 |
SMILES |
OC(C(CCC)=O)CCC |
SPLASH |
splash10-05fu-9000000000-50532c076e475c5ec3c0 |
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 |
4-Octanone, 5-hydroxy- |
Wiley ID |
LM_FFNSC3_501 |