SpectraBase Spectrum ID |
7ozConfi62X |
Name |
(3S,4S,5R,8R)-5-Methyl-8-propan-2-yl-2-oxadispiro[2.0.5^{4}.3^{3}]dodecane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
222.198365456 u |
Formula |
C15H26O |
InChI |
InChI=1S/C15H26O/c1-11(2)13-6-5-12(3)14(9-13)7-4-8-15(14)10-16-15/h11-13H,4-10H2,1-3H3/t12-,13-,14+,15-/m1/s1 |
InChIKey |
OXXLSDSOFWIKHA-APIJFGDWSA-N |
Molecular Weight |
222.372 g/mol |
SMILES |
[C@@]12([C@]3(C[C@](C(C)C)(CC[C@]3(C)[H])[H])CCC1)OC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.861026 |