| SpectraBase Spectrum ID |
46MJFScGqH3 |
| Name |
Octanediol<1,8-> |
| CAS Registry Number |
629-41-4 |
| 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 |
146.130679818 u |
| Formula |
C8H18O2 |
| 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/C8H18O2/c9-7-5-3-1-2-4-6-8-10/h9-10H,1-8H2 |
| InChIKey |
OEIJHBUUFURJLI-UHFFFAOYSA-N |
| Molecular Weight |
146.230 g/mol |
| Nominal Mass |
146 u |
| Number of Peaks |
53 |
| SMILES |
OCCCCCCCCO |
| SPLASH |
splash10-067l-9000000000-62a5c17503e162fa13f7 |
| Source |
ex PFATZ ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001967 |
