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Dimethyl 2-(biphenyl-4-yl)cyclopropane-1,1-dicarboxylate

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

Dimethyl 2-(biphenyl-4-yl)cyclopropane-1,1-dicarboxylate
SpectraBase Compound ID LPKSd8bntGA
InChI InChI=1S/C19H18O4/c1-22-17(20)19(18(21)23-2)12-16(19)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11,16H,12H2,1-2H3
InChIKey WQVCDKFRZYQOPA-UHFFFAOYSA-N
Mol Weight 310.35 g/mol
Molecular Formula C19H18O4
Exact Mass 310.120509 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 33yQrXK1rcP
Name Dimethyl 2-(biphenyl-4-yl)cyclopropane-1,1-dicarboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.120509056 u
Formula C19H18O4
InChI InChI=1S/C19H18O4/c1-22-17(20)19(18(21)23-2)12-16(19)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-11,16H,12H2,1-2H3
InChIKey WQVCDKFRZYQOPA-UHFFFAOYSA-N
Molecular Weight 310.349 g/mol
SMILES C1(C(C1)C=1C=CC(=CC1)C=1C=CC=CC1)(C(=O)OC)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963388