SpectraBase Spectrum ID |
Hq0bGjBQFwH |
Name |
Butyraldehyde <2-ethyl-> |
Source of Sample |
SAFC Cat.no. 110094 |
CAS Registry Number |
97-96-1 |
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 |
100.088815005 u |
Formula |
C6H12O |
InChI |
InChI=1S/C6H12O/c1-3-6(4-2)5-7/h5-6H,3-4H2,1-2H3 |
InChIKey |
UNNGUFMVYQJGTD-UHFFFAOYSA-N |
Molecular Weight |
100.161 g/mol |
Number of Peaks |
50 |
RI1 |
745 |
RI2 |
419 |
RI3 |
411 |
RI4 |
380 |
RI5 |
738 |
SMILES |
CCC(C=O)CC |
SPLASH |
splash10-0006-9000000000-ca7fe7beac8eb2effdd7 |
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 |
Butanal, 2-ethyl- |
Wiley ID |
LM_FFNSC3_1623 |