SpectraBase Spectrum ID |
KmvlwtMrnJq |
Name |
Longicamphenylone |
CAS Registry Number |
58560-59-1 |
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 |
206.167065327 u |
Formula |
C14H22O |
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/C14H22O/c1-13(2)7-4-8-14(3)10-6-5-9(11(10)13)12(14)15/h9-11H,4-8H2,1-3H3/t9-,10+,11-,14-/m0/s1 |
InChIKey |
SXPTWBDKLVMRLI-MIJXAVMKSA-N |
Molecular Weight |
206.329 g/mol |
Nominal Mass |
206 u |
Number of Peaks |
134 |
SMILES |
[C@@]12([C@]3(CC[C@@]2(C([C@]3(CCCC1(C)C)C)=O)[H])[H])[H] |
SPLASH |
splash10-052f-9500000000-be5a3645b7a944d77b46 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA000859 |