| SpectraBase Spectrum ID |
3qs8y1IDSnG |
| Name |
Neryl isobutanoate |
| CAS Registry Number |
2345-24-6 |
| 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 |
224.177630011 u |
| Formula |
C14H24O2 |
| 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/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9- |
| InChIKey |
OGJYXQFXLSCKTP-LCYFTJDESA-N |
| Molecular Weight |
224.344 g/mol |
| Nominal Mass |
224 u |
| Number of Peaks |
91 |
| SMILES |
C(C(C)C)(=O)OC\C=C/(CCC=C(C)C)C |
| SPLASH |
splash10-00kf-9000000000-334458de4809540fde7a |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001922 |
