SpectraBase Spectrum ID |
1SLbmJqnEVh |
Name |
2-Methyl-(8'-methylundeca-4',9'-dienyl)-1,3-dioxolane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
252.208930140 u |
Formula |
C16H28O2 |
InChI |
InChI=1S/C16H28O2/c1-4-10-15(2)11-8-6-5-7-9-12-16(3)17-13-14-18-16/h4-6,10,15H,7-9,11-14H2,1-3H3/b6-5-,10-4+/t15-/m1/s1 |
InChIKey |
VDNHXAHBIFZTPM-FVADKKBWSA-N |
Molecular Weight |
252.398 g/mol |
SMILES |
C1(OCCO1)(CCC\C=C/CC[C@@](\C=C\C)(C)[H])C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.869565 |