SpectraBase Spectrum ID |
GLgzMDpx6Gd |
Name |
(+)-4.alpha.-acetoxy-2-carene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
194.130679818 u |
Formula |
C12H18O2 |
InChI |
InChI=1S/C12H18O2/c1-7-5-9-10(12(9,3)4)6-11(7)14-8(2)13/h5,9-11H,6H2,1-4H3/t9?,10?,11-/m1/s1 |
InChIKey |
MNFUDBPDIYQVKJ-VQXHTEKXSA-N |
Molecular Weight |
194.274 g/mol |
SMILES |
C12C(C[C@](C(=C2)C)(OC(=O)C)[H])C1(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955894 |