| SpectraBase Spectrum ID |
F9YDLbjHZCh |
| Name |
()-trans-Whisky Lactone |
| CAS Registry Number |
39638-67-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H16O2 |
| InChI |
InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1 |
| InChIKey |
WNVCMFHPRIBNCW-SFYZADRCSA-N |
| Molecular Weight |
156.225 g/mol |
| SMILES |
C1(O[C@]([C@@](C1)(C)[H])(CCCC)[H])=O |
| SPLASH |
splash10-0a4i-0900000000-a327ea012c3993e19d60 |
| Source of Spectrum |
U1-2010-692-14 |
| Synonyms |
(+)-trans-Whisky Lactone
(4R,5S)-5-Butyl-4-methyl-dihydro-furan-2-one
(4R,5S)-5-butyl-4-methyl-2-oxolanone
(4R,5S)-5-butyl-4-methyloxolan-2-one
(4R,5S)-5-butyl-4-methyl-oxolan-2-one |
| Wiley ID |
1663332 |
