SpectraBase Spectrum ID |
6x0zfLpuI7X |
Name |
Isobornyl n-butanoate |
CAS Registry Number |
107910-89-4 |
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/c1-5-6-12(15)16-11-9-10-7-8-14(11,4)13(10,2)3/h10-11H,5-9H2,1-4H3/t10-,11-,14+/m1/s1 |
InChIKey |
VIPNQHBVIDJXJE-GYSYKLTISA-N |
Molecular Weight |
224.344 g/mol |
Nominal Mass |
224 u |
Number of Peaks |
87 |
SMILES |
C(C(O[C@@]1(C[C@]2(CC[C@]1(C)C2(C)C)[H])[H])=O)CC |
SPLASH |
splash10-006x-9300000000-3eb56500a3abe82603a9 |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
RA002203 |