| SpectraBase Spectrum ID |
9SkmOR7IlLw |
| Name |
Neryl acetone |
| CAS Registry Number |
3879-26-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9- |
| InChIKey |
HNZUNIKWNYHEJJ-XFXZXTDPSA-N |
| Molecular Weight |
194.318 g/mol |
| SMILES |
C(\C=C/(CCC=C(C)C)C)CC(C)=O |
| SPLASH |
splash10-0006-9200000000-e2a2a983eedccf2ed455 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1887681 |
