| SpectraBase Spectrum ID |
ItuLg7Thmps |
| Name |
3,5-Dimethyl-4-heptanone |
| Alternate Name(s) |
Dimethyl-4-heptanone<3,5-> |
| CAS Registry Number |
19549-84-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H18O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C9H18O/c1-5-7(3)9(10)8(4)6-2/h7-8H,5-6H2,1-4H3 |
| InChIKey |
VZXXYILNWWRSGE-UHFFFAOYSA-N |
| Molecular Weight |
142.242 g/mol |
| SMILES |
C(C(=O)C(C)CC)(C)CC |
| SPLASH |
splash10-0a4i-9000000000-4749ca3c6920e6a85abd |
| Source |
ex ALDRICH ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1887319 |
