| SpectraBase Spectrum ID |
650HrC52Ejr |
| Name |
3-Methyl-1,2-cyclohexanedione |
| CAS Registry Number |
3008-43-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H10O2 |
| 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/C7H10O2/c1-5-3-2-4-6(8)7(5)9/h5H,2-4H2,1H3 |
| InChIKey |
JDXJKLGWPNXSHL-UHFFFAOYSA-N |
| Molecular Weight |
126.155 g/mol |
| SMILES |
C1(CCCC(C1=O)C)=O |
| SPLASH |
splash10-0536-9100000000-ba6ed91ebef0525c6e43 |
| Source |
ex ALDRICH |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Cyclohexanedione<3-methyl-1,2-> |
| Wiley ID |
1886187 |
