| SpectraBase Spectrum ID |
AtzVbt7OWKI |
| Name |
Hexenyl pyruvate<3Z-> |
| CAS Registry Number |
68133-76-6 |
| 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 |
170.094294308 u |
| Formula |
C9H14O3 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C9H14O3/c1-3-4-5-6-7-12-9(11)8(2)10/h4-5H,3,6-7H2,1-2H3/b5-4- |
| InChIKey |
LKNXTZXOBHAYSR-PLNGDYQASA-N |
| Molecular Weight |
170.208 g/mol |
| Nominal Mass |
170 u |
| Number of Peaks |
40 |
| SMILES |
C(OCC\C=C/CC)(=O)C(C)=O |
| SPLASH |
splash10-052f-9000000000-fe72619829d261377b87 |
| Source |
ex BEDOUDIAN RES. |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001739 |
