SpectraBase Spectrum ID |
LYlIquNjkIr |
Name |
(3R)-3-Methyl-1-cyclopentadec-5-ynol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.214015521 u |
Formula |
C16H28O |
InChI |
InChI=1S/C16H28O/c1-15-12-10-8-6-4-2-3-5-7-9-11-13-16(17)14-15/h15-17H,2-7,9,11-14H2,1H3/t15-,16?/m1/s1 |
InChIKey |
OEGZBPVUQUNPSD-AAFJCEBUSA-N |
Molecular Weight |
236.399 g/mol |
SMILES |
C1(C[C@@](CC#CCCCCCCCCC1)(C)[H])O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931078 |