SpectraBase Spectrum ID |
CesF38gdGs4 |
Name |
Benzene, 1,1'-pentylidenebis- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
224.156500644 u |
Formula |
C17H20 |
InChI |
InChI=1S/C17H20/c1-2-3-14-17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3 |
InChIKey |
GSGNVNZDHCKRGI-UHFFFAOYSA-N |
Molecular Weight |
224.347 g/mol |
SMILES |
C1(=CC=CC=C1)C(C1=CC=CC=C1)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969409 |