| SpectraBase Spectrum ID |
2H6G3VwCvbj |
| Name |
(2S,5R)-2,5-dimethyl-heptan-5-olide |
| Classification |
Delta valerolactones |
| 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 |
156.115029753 u |
| Formula |
C9H16O2 |
| InChI |
InChI=1S/C9H16O2/c1-4-9(3)6-5-7(2)8(10)11-9/h7H,4-6H2,1-3H3/t7-,9+/m0/s1 |
| InChIKey |
KXMUUSMNMBIDHO-IONNQARKSA-N |
| Molecular Weight |
156.225 g/mol |
| Number of Peaks |
16 |
| SMILES |
C1C[C@@](CC)(OC([C@]1(C)[H])=O)C |
| SPLASH |
splash10-0596-9200000000-42ed5942f245540c9f64 |
| Source of Spectrum |
FF-13-207-32_isomer_2 (DOI: 10.1002_(SICI)1099-1026(199805_06)13_3_203) |
| Synonyms |
(3S,6R)-6-ethyl-3,6-dimethyltetrahydro-2H-pyran-2-one |
| Wiley ID |
1775178 |
