| SpectraBase Spectrum ID |
KeUVip0qdg8 |
| Name |
Methyl 2-butyryl-5-oxohexanoate |
| Appearance |
Yellowish liquid |
| Carrier Gas |
Helium (0.7 mL/min) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H30O7 |
| GC Column |
HP-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 300 oC |
| InChI |
InChI=1S/C11H18O4.C7H12O3/c1-4-5-10(13)9(11(14)15-3)7-6-8(2)12;1-6(8)4-3-5-7(9)10-2/h9H,4-7H2,1-3H3;3-5H2,1-2H3 |
| InChIKey |
PVJALFKDIUIRFJ-UHFFFAOYSA-N |
| Inlet Type |
Split (90:1) |
| Instrument Name |
Agilent 7890A GC-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.202300050 |
| Molecular Weight |
358.431 g/mol |
| Quality |
471 |
| SMILES |
CC(=O)CCCC(OC)=O.CC(=O)CCC(C(=O)CCC)C(OC)=O |
| SPLASH |
splash10-006x-9300000000-9a287f6a1aa347f5d9ab |
| Source of Spectrum |
ASC-365-SM42-1a (DOI: 10.1002/adsc.202300050) |
| Thin-Layer Chromatography |
0.40 (silica gel 60, cyclohexane/EtOAc, 2:1) |
| Wiley ID |
1909654 |
