SpectraBase Spectrum ID |
HotMs6P97Ws |
Name |
2,3-Dibutyl-1,4-dihydronaphthalene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
242.203450837 u |
Formula |
C18H26 |
InChI |
InChI=1S/C18H26/c1-3-5-9-15-13-17-11-7-8-12-18(17)14-16(15)10-6-4-2/h7-8,11-12H,3-6,9-10,13-14H2,1-2H3 |
InChIKey |
OWPRNIKCELCWML-UHFFFAOYSA-N |
Molecular Weight |
242.406 g/mol |
SMILES |
C=1C=C2C(=CC1)CC(=C(C2)CCCC)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964826 |