SpectraBase Spectrum ID |
9GNglBJjlup |
Name |
10-alpha-Hydroxy-delta-9(15)-africanene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
220.182715392 u |
Formula |
C15H24O |
InChI |
InChI=1S/C15H24O/c1-9-11-8-14(2,3)6-10-7-15(10,4)12(11)5-13(9)16/h10-13,16H,1,5-8H2,2-4H3/t10-,11+,12+,13-,15+/m0/s1 |
InChIKey |
RQNUKTXYMSOBCN-IHWVXMPCSA-N |
Molecular Weight |
220.356 g/mol |
SMILES |
[C@]1(O)(C(=C)[C@@]2([C@@](C1)([C@]1(C)C[C@@]1(CC(C)(C)C2)[H])[H])[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810172 |