SpectraBase Spectrum ID |
Iym5vw5qWwY |
Name |
Benzene, 1-methoxy-3-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
262.229665585 u |
Formula |
C18H30O |
InChI |
InChI=1S/C18H30O/c1-3-4-5-6-7-8-9-10-11-13-17-14-12-15-18(16-17)19-2/h12,14-16H,3-11,13H2,1-2H3 |
InChIKey |
MRSPSSYGTSURFF-UHFFFAOYSA-N |
Molecular Weight |
262.437 g/mol |
SMILES |
C(CC1=CC(OC)=CC=C1)CCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837656 |