| SpectraBase Spectrum ID |
30epOTLyD2 |
| Name |
Elemol |
| CAS Registry Number |
639-99-6 |
| 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 |
222.198365456 u |
| Formula |
C15H26O |
| 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/C15H26O/c1-7-15(6)9-8-12(14(4,5)16)10-13(15)11(2)3/h7,12-13,16H,1-2,8-10H2,3-6H3/t12?,13-,15+/m0/s1 |
| InChIKey |
GFJIQNADMLPFOW-RGPPAHDHSA-N |
| Molecular Weight |
222.372 g/mol |
| Nominal Mass |
222 u |
| Number of Peaks |
154 |
| SMILES |
OC(C1C[C@]([C@@](C=C)(C)CC1)(C(C)=C)[H])(C)C |
| SPLASH |
splash10-052f-9400000000-119ef99dea8610c93fb3 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000520 |
