SpectraBase Spectrum ID |
B6RQakD0TeK |
Name |
2-(2-Chloro-4-phenoxyphenoxy)ethyl tetrahydro-2H-pyran-2-yl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
348.112836852 u |
Formula |
C19H21ClO4 |
InChI |
InChI=1S/C19H21ClO4/c20-17-14-16(24-15-6-2-1-3-7-15)9-10-18(17)21-12-13-23-19-8-4-5-11-22-19/h1-3,6-7,9-10,14,19H,4-5,8,11-13H2 |
InChIKey |
BWWHYXXNJUWOKN-UHFFFAOYSA-N |
Molecular Weight |
348.826 g/mol |
SMILES |
C1(OCCOC=2C(=CC(=CC2)OC=2C=CC=CC2)Cl)CCCCO1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858684 |