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2,2-Dimethyl-3,3-(1',2'-ethylidene)-1,2-dihydrobenzofuran

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

2,2-Dimethyl-3,3-(1',2'-ethylidene)-1,2-dihydrobenzofuran
SpectraBase Compound ID 5FSBKn7Jx1F
InChI InChI=1S/C12H14O/c1-11(2)12(7-8-12)9-5-3-4-6-10(9)13-11/h3-6H,7-8H2,1-2H3
InChIKey ATLRBULJVBEIAT-UHFFFAOYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C12H14O
Exact Mass 174.104465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CIouLB7958Q
Name 2,2-Dimethyl-3,3-(1',2'-ethylidene)-1,2-dihydrobenzofuran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 174.104465070 u
Formula C12H14O
InChI InChI=1S/C12H14O/c1-11(2)12(7-8-12)9-5-3-4-6-10(9)13-11/h3-6H,7-8H2,1-2H3
InChIKey ATLRBULJVBEIAT-UHFFFAOYSA-N
Molecular Weight 174.243 g/mol
SMILES C12(C(OC=3C2=CC=CC3)(C)C)CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.908538