SpectraBase Spectrum ID |
JU2A4EIc1vJ |
Name |
3-(Phenylmethylene)-2,2-diethyltetrahydrofuran |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
216.151415263 u |
Formula |
C15H20O |
InChI |
InChI=1S/C15H20O/c1-3-15(4-2)14(10-11-16-15)12-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3/b14-12- |
InChIKey |
XYYWFMATQHXLJN-OWBHPGMISA-N |
Molecular Weight |
216.324 g/mol |
SMILES |
C=1(\C=C/2C(OCC2)(CC)CC)C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953173 |