For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-Piperidinone, 3-(4-bromobutyl)-1-(phenylmethyl)-

View entire compound with spectra: 1 NMR, and 1 FTIR

4-Piperidinone, 3-(4-bromobutyl)-1-(phenylmethyl)-
SpectraBase Compound ID 3JfCj84up3M
InChI InChI=1S/C16H22BrNO/c17-10-5-4-8-15-13-18(11-9-16(15)19)12-14-6-2-1-3-7-14/h1-3,6-7,15H,4-5,8-13H2
InChIKey HYOLNMBPKSXHPU-UHFFFAOYSA-N
Mol Weight 324.26 g/mol
Molecular Formula C16H22BrNO
Exact Mass 323.088477 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 86dKblfvTni
Name 4-Piperidinone, 3-(4-bromobutyl)-1-(phenylmethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.088477331 u
Formula C16H22BrNO
InChI InChI=1S/C16H22BrNO/c17-10-5-4-8-15-13-18(11-9-16(15)19)12-14-6-2-1-3-7-14/h1-3,6-7,15H,4-5,8-13H2
InChIKey HYOLNMBPKSXHPU-UHFFFAOYSA-N
Molecular Weight 324.262 g/mol
SMILES C1(C(CN(CC1)CC1=CC=CC=C1)CCCCBr)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.85668