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N-3-Fluorophenyl-N-[1-(1-phenylpropyl)piperidin-4-yl]benzamide
SpectraBase Compound ID 7zR0kseyGha
InChI InChI=1S/C27H29FN2O/c1-2-26(21-10-5-3-6-11-21)29-18-16-24(17-19-29)30(25-15-9-14-23(28)20-25)27(31)22-12-7-4-8-13-22/h3-15,20,24,26H,2,16-19H2,1H3
InChIKey UNRGHWXUGDCQLB-UHFFFAOYSA-N
Mol Weight 416.54 g/mol
Molecular Formula C27H29FN2O
Exact Mass 416.226392 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DCU4GZN66AR
Name N-3-Fluorophenyl-N-[1-(1-phenylpropyl)piperidin-4-yl]benzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.226391724 u
Formula C27H29FN2O
InChI InChI=1S/C27H29FN2O/c1-2-26(21-10-5-3-6-11-21)29-18-16-24(17-19-29)30(25-15-9-14-23(28)20-25)27(31)22-12-7-4-8-13-22/h3-15,20,24,26H,2,16-19H2,1H3
InChIKey UNRGHWXUGDCQLB-UHFFFAOYSA-N
Molecular Weight 416.540 g/mol
SMILES C1(N(C=2C=C(C=CC2)F)C(C=2C=CC=CC2)=O)CCN(C(C=2C=CC=CC2)CC)CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.838692