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(4-(N-Propyloxycarbonyl)oxyphenyl)acetic acid, N-propyl ester

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(4-(N-Propyloxycarbonyl)oxyphenyl)acetic acid, N-propyl ester
SpectraBase Compound ID 5e63OEycsHF
InChI InChI=1S/C15H20O5/c1-3-9-18-14(16)11-12-5-7-13(8-6-12)20-15(17)19-10-4-2/h5-8H,3-4,9-11H2,1-2H3
InChIKey IRQDEBIHQLXAHF-UHFFFAOYSA-N
Mol Weight 280.32 g/mol
Molecular Formula C15H20O5
Exact Mass 280.131074 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9xS3ABPj3VE
Name (4-(N-Propyloxycarbonyl)oxyphenyl)acetic acid, N-propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.131073739 u
Formula C15H20O5
InChI InChI=1S/C15H20O5/c1-3-9-18-14(16)11-12-5-7-13(8-6-12)20-15(17)19-10-4-2/h5-8H,3-4,9-11H2,1-2H3
InChIKey IRQDEBIHQLXAHF-UHFFFAOYSA-N
SMILES C(CC1=CC=C(C=C1)OC(OCCC)=O)(OCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.979505