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Tert-butyl 2-(2,2-dimethylpropanoyl)-1-naphthoate

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

Tert-butyl 2-(2,2-dimethylpropanoyl)-1-naphthoate
SpectraBase Compound ID 8S5R2XoW3J7
InChI InChI=1S/C20H24O3/c1-19(2,3)17(21)15-12-11-13-9-7-8-10-14(13)16(15)18(22)23-20(4,5)6/h7-12H,1-6H3
InChIKey MPKVKDQDDNJKOL-UHFFFAOYSA-N
Mol Weight 312.41 g/mol
Molecular Formula C20H24O3
Exact Mass 312.172545 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 82TWp5hNe7D
Name Tert-butyl 2-(2,2-dimethylpropanoyl)-1-naphthoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.172544630 u
Formula C20H24O3
InChI InChI=1S/C20H24O3/c1-19(2,3)17(21)15-12-11-13-9-7-8-10-14(13)16(15)18(22)23-20(4,5)6/h7-12H,1-6H3
InChIKey MPKVKDQDDNJKOL-UHFFFAOYSA-N
Molecular Weight 312.409 g/mol
SMILES C=1(C(C(OC(C)(C)C)=O)=C2C=CC=CC2=CC1)C(C(C)(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.939912