| SpectraBase Spectrum ID |
KwGHjZRj8eQ |
| Name |
Citronellic acid |
| CAS Registry Number |
502-47-6 |
| 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 |
170.130679818 u |
| Formula |
C10H18O2 |
| 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/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12) |
| InChIKey |
GJWSUKYXUMVMGX-UHFFFAOYSA-N |
| Molecular Weight |
170.252 g/mol |
| Nominal Mass |
170 u |
| Number of Peaks |
47 |
| SMILES |
OC(=O)CC(CCC=C(C)C)C |
| SPLASH |
splash10-00kf-9000000000-6f11bfd56dbddfa6117e |
| Source |
ex ALDRICH |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001489 |
