SpectraBase Spectrum ID |
FoeLKARfEpD |
Name |
Benzene, (1-ethylundecyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.250401030 u |
Formula |
C19H32 |
InChI |
InChI=1S/C19H32/c1-3-5-6-7-8-9-10-12-15-18(4-2)19-16-13-11-14-17-19/h11,13-14,16-18H,3-10,12,15H2,1-2H3 |
InChIKey |
VZZMNLVGDGMQQV-UHFFFAOYSA-N |
Molecular Weight |
260.465 g/mol |
SMILES |
C(C(CC)C1=CC=CC=C1)CCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955204 |