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3-(4-(N-Propyloxycarbonyl)oxy-3-methoxyphenyl)-2-propenal

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3-(4-(N-Propyloxycarbonyl)oxy-3-methoxyphenyl)-2-propenal
SpectraBase Compound ID JLTBLC37gFL
InChI InChI=1S/C14H16O5/c1-3-9-18-14(16)19-12-7-6-11(5-4-8-15)10-13(12)17-2/h4-8,10H,3,9H2,1-2H3/b5-4+
InChIKey HHVBDHZASRKXCW-SNAWJCMRSA-N
Mol Weight 264.28 g/mol
Molecular Formula C14H16O5
Exact Mass 264.099774 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7sB7AlALJUv
Name 3-(4-(N-Propyloxycarbonyl)oxy-3-methoxyphenyl)-2-propenal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.099773610 u
Formula C14H16O5
InChI InChI=1S/C14H16O5/c1-3-9-18-14(16)19-12-7-6-11(5-4-8-15)10-13(12)17-2/h4-8,10H,3,9H2,1-2H3/b5-4+
InChIKey HHVBDHZASRKXCW-SNAWJCMRSA-N
Molecular Weight 264.277 g/mol
SMILES C(\C=C\C1=CC(OC)=C(C=C1)OC(OCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938843