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Tert-butyl[2-(allyloxy)phenyl](oxo)acetate

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

Tert-butyl[2-(allyloxy)phenyl](oxo)acetate
SpectraBase Compound ID 1via3IOKhMd
InChI InChI=1S/C15H18O4/c1-5-10-18-12-9-7-6-8-11(12)13(16)14(17)19-15(2,3)4/h5-9H,1,10H2,2-4H3
InChIKey QJPNUQGWILEGMN-UHFFFAOYSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7BqKG7pB958
Name Tert-butyl[2-(allyloxy)phenyl](oxo)acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.120509056 u
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-5-10-18-12-9-7-6-8-11(12)13(16)14(17)19-15(2,3)4/h5-9H,1,10H2,2-4H3
InChIKey QJPNUQGWILEGMN-UHFFFAOYSA-N
Molecular Weight 262.305 g/mol
SMILES C(C(C=1C(OCC=C)=CC=CC1)=O)(OC(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.893228