| SpectraBase Spectrum ID |
1ZTl5qxwKu |
| Name |
3-benzyl-3,6-dimethyl-pyran-2,4-dione |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
230.094294308 u |
| Formula |
C14H14O3 |
| InChI |
InChI=1S/C14H14O3/c1-10-8-12(15)14(2,13(16)17-10)9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3 |
| InChIKey |
IQVFXQVJVXEAJG-UHFFFAOYSA-N |
| Inlet Type |
Split injector |
| Instrument Name |
HP 7890B-5977A inert mass detector |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800621 |
| Molecular Weight |
230.263 g/mol |
| Quality |
425 |
| Reported Formula |
C14H14O3 |
| SMILES |
C1(OC(=CC(C1(C)CC1=CC=CC=C1)=O)C)=O |
| SPLASH |
splash10-0gbl-2930000000-39e431a2fc47e2973b44 |
| Source of Spectrum |
K1-2018-3154-38 (DOI: 10.1002/ejoc.201800621) |
| Thin-Layer Chromatography |
0.78 (cyclohexane/EtOAc, 1:1) |
| Wiley ID |
1894080 |
