| SpectraBase Spectrum ID |
40ARqsWGeCM |
| Name |
Pentanal |
| CAS Registry Number |
110-62-3 |
| 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 |
86.073164941 u |
| Formula |
C5H10O |
| 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/C5H10O/c1-2-3-4-5-6/h5H,2-4H2,1H3 |
| InChIKey |
HGBOYTHUEUWSSQ-UHFFFAOYSA-N |
| Molecular Weight |
86.134 g/mol |
| Nominal Mass |
86 u |
| Number of Peaks |
40 |
| SMILES |
C(CCC)C=O |
| SPLASH |
splash10-0006-9000000000-d19aa81b135fb04ef69a |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001999 |
