| SpectraBase Spectrum ID |
JgnYxlB91CE |
| Name |
Biotone |
| CAS Registry Number |
19902-29-5 |
| 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 |
218.167065327 u |
| Formula |
C15H22O |
| 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/C15H22O/c1-9-5-6-15-8-11(9)14(3,4)13(15)12(16)7-10(15)2/h10-11,13H,1,5-8H2,2-4H3/t10-,11+,13+,15+/m1/s1 |
| InChIKey |
DAOLNGOJJZRASM-MPXAEWJHSA-N |
| Molecular Weight |
218.340 g/mol |
| Nominal Mass |
218 u |
| Number of Peaks |
114 |
| SMILES |
[C@]123[C@](C([C@@](C(CC3)=C)([H])C1)(C)C)(C(C[C@]2(C)[H])=O)[H] |
| SPLASH |
splash10-0604-7910000000-bc6afde4551142e71f6a |
| Source |
ex ARMUNDO LARA |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000170 |
