| SpectraBase Spectrum ID |
imGqzpUbX4 |
| Name |
2-(3-Oxobutyl)isomenthone |
| Alternate Name(s) |
Isomenthone<2-(3-oxobutyl-)-> |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H24O2 |
| 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/C14H24O2/c1-5-6-12(15)13-10(4)7-8-11(9(2)3)14(13)16/h9-11,13H,5-8H2,1-4H3/t10-,11-,13+/m1/s1 |
| InChIKey |
PQTYCNAGRRNLRY-WZRBSPASSA-N |
| Molecular Weight |
224.344 g/mol |
| SMILES |
C1C[C@@](C([C@@]([C@@]1(C)[H])(C(CCC)=O)[H])=O)(C(C)C)[H] |
| SPLASH |
splash10-0006-9100000000-5037eea652be899785c9 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1887941 |
