SpectraBase Spectrum ID |
IBYF2cOxvGf |
Name |
2-[2-(2-Chloro-ethoxy)-ethoxy]-7-methoxy-fluoren-9-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
332.081536723 u |
Formula |
C18H17ClO4 |
InChI |
InChI=1S/C18H17ClO4/c1-21-12-2-4-14-15-5-3-13(23-9-8-22-7-6-19)11-17(15)18(20)16(14)10-12/h2-5,10-11H,6-9H2,1H3 |
InChIKey |
ROEZRDVRVJAXIN-UHFFFAOYSA-N |
Molecular Weight |
332.783 g/mol |
SMILES |
C1=2C(C3=CC(OCCOCCCl)=CC=C3C2C=CC(=C1)OC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937692 |