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Dimethyl (R)-2-[1-(3-methoxyphenyl)allyl]malonate

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

Dimethyl (R)-2-[1-(3-methoxyphenyl)allyl]malonate
SpectraBase Compound ID FRTbhNSfjc8
InChI InChI=1S/C15H18O5/c1-5-12(10-7-6-8-11(9-10)18-2)13(14(16)19-3)15(17)20-4/h5-9,12-13H,1H2,2-4H3/t12-/m0/s1
InChIKey VBOFXPWDWFBWPH-LBPRGKRZSA-N
Mol Weight 278.3 g/mol
Molecular Formula C15H18O5
Exact Mass 278.115424 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H5339sXmwAE
Name Dimethyl (R)-2-[1-(3-methoxyphenyl)allyl]malonate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.115423675 u
Formula C15H18O5
InChI InChI=1S/C15H18O5/c1-5-12(10-7-6-8-11(9-10)18-2)13(14(16)19-3)15(17)20-4/h5-9,12-13H,1H2,2-4H3/t12-/m0/s1
InChIKey VBOFXPWDWFBWPH-LBPRGKRZSA-N
SMILES C(C(C(=O)OC)[C@@](C=C)(C=1C=C(C=CC1)OC)[H])(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937656