For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-Methyl-2-(3-phenylprop-2-ynyloxy)benzene

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-Methyl-2-(3-phenylprop-2-ynyloxy)benzene
SpectraBase Compound ID 2nMhTjSfdex
InChI InChI=1S/C16H14O/c1-14-8-5-6-12-16(14)17-13-7-11-15-9-3-2-4-10-15/h2-6,8-10,12H,13H2,1H3
InChIKey TWEWZKOOLZHHMH-UHFFFAOYSA-N
Mol Weight 222.29 g/mol
Molecular Formula C16H14O
Exact Mass 222.104465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HJQQI9Yr4VG
Name 1-Methyl-2-(3-phenylprop-2-ynyloxy)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.104465070 u
Formula C16H14O
InChI InChI=1S/C16H14O/c1-14-8-5-6-12-16(14)17-13-7-11-15-9-3-2-4-10-15/h2-6,8-10,12H,13H2,1H3
InChIKey TWEWZKOOLZHHMH-UHFFFAOYSA-N
Molecular Weight 222.287 g/mol
SMILES C=1(C(=CC=CC1)OCC#CC=1C=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953329