SpectraBase Spectrum ID |
AYR0wJUjL9r |
Name |
1-Naphthalenepropanol, .alpha.-ethyldecahydro-.alpha.,2,5,5,8A-pentamethyl-, [1R-[1.alpha.(R*),2.beta.,4A.beta.,8A.alpha.]]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
310.287180462 u |
Formula |
C20H38O2 |
InChI |
InChI=1S/C20H38O2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h15-16,21-22H,7-14H2,1-6H3/t15-,16+,18+,19-,20+/m0/s1 |
InChIKey |
VWPNQCLIQCRCCG-GRLGQGAKSA-N |
Molecular Weight |
310.522 g/mol |
SMILES |
[C@@]12([C@](C(C)(C)CCC2)(CC[C@]([C@@]1(CC[C@](O)(CC)C)[H])(O)C)[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935891 |