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4-Methoxybenzylamine, N,N-bis(pentafluoropropionyl)-
SpectraBase Compound ID 1sXeymcaqWo
InChI InChI=1S/C14H9F10NO3/c1-28-8-4-2-7(3-5-8)6-25(9(26)11(15,16)13(19,20)21)10(27)12(17,18)14(22,23)24/h2-5H,6H2,1H3
InChIKey CQRPRLIGVBUDRQ-UHFFFAOYSA-N
Mol Weight 429.21 g/mol
Molecular Formula C14H9F10NO3
Exact Mass 429.042275 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B81fDD4n6DN
Name 4-Methoxybenzylamine, N,N-bis(pentafluoropropionyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 429.042274781 u
Formula C14H9F10NO3
InChI InChI=1S/C14H9F10NO3/c1-28-8-4-2-7(3-5-8)6-25(9(26)11(15,16)13(19,20)21)10(27)12(17,18)14(22,23)24/h2-5H,6H2,1H3
InChIKey CQRPRLIGVBUDRQ-UHFFFAOYSA-N
Molecular Weight 429.214 g/mol
SMILES C1=C(C=CC(=C1)OC)CN(C(=O)C(F)(C(F)(F)F)F)C(C(C(F)(F)F)(F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.898177