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Benzeneethanamine, 2-fluoro-4,5-dibenzyloxy-.beta.-hydroxy-.alpha.-methyl-
SpectraBase Compound ID 6D1vW43ZxNz
InChI InChI=1S/C23H24FNO3/c1-16(25)23(26)19-12-21(27-14-17-8-4-2-5-9-17)22(13-20(19)24)28-15-18-10-6-3-7-11-18/h2-13,16,23,26H,14-15,25H2,1H3
InChIKey OINMPXYSVIEUSL-UHFFFAOYSA-N
Mol Weight 381.45 g/mol
Molecular Formula C23H24FNO3
Exact Mass 381.174022 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Kegd9sRDvMs
Name Benzeneethanamine, 2-fluoro-4,5-dibenzyloxy-.beta.-hydroxy-.alpha.-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.174021797 u
Formula C23H24FNO3
InChI InChI=1S/C23H24FNO3/c1-16(25)23(26)19-12-21(27-14-17-8-4-2-5-9-17)22(13-20(19)24)28-15-18-10-6-3-7-11-18/h2-13,16,23,26H,14-15,25H2,1H3
InChIKey OINMPXYSVIEUSL-UHFFFAOYSA-N
Molecular Weight 381.447 g/mol
SMILES C1(=C(C=C(C(=C1)OCC1=CC=CC=C1)OCC1=CC=CC=C1)C(C(C)N)O)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871946