SpectraBase Spectrum ID |
JhBWM1mFwUD |
Name |
5,8-Diacetoxy-exo-2:3-epoxytricyclo[5.2.1.0(4,10)]decane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.115423675 u |
Formula |
C14H18O5 |
InChI |
InChI=1S/C14H18O5/c1-5(15)17-9-4-8-11-7(9)3-10(18-6(2)16)12(11)14-13(8)19-14/h7-14H,3-4H2,1-2H3/t7?,8?,9-,10+,11?,12?,13?,14?/m0/s1 |
InChIKey |
DPJXYXNTLXTGNU-PQMKWLGYSA-N |
Molecular Weight |
266.293 g/mol |
SMILES |
C12C(C3C[C@@](C4C3C2[C@@](C4)(OC(=O)C)[H])(OC(=O)C)[H])O1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912895 |