Phenyl-pa-M9:0 [5-phenylnonyl-N-methylpiperizinamide]

SpectraBase Compound ID	1xoT6Wr6EG3
InChI	InChI=1S/C20H32N2O/c1-21-15-17-22(18-16-21)20(23)14-10-5-3-2-4-7-11-19-12-8-6-9-13-19/h6,8-9,12-13H,2-5,7,10-11,14-18H2,1H3
InChIKey	DMXKRHDBVOLHRU-UHFFFAOYSA-N Google Search
Mol Weight	316.5 g/mol
Molecular Formula	C20H32N2O
Exact Mass	316.251464 g/mol

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SpectraBase Spectrum ID	H8BhoQCSn3S
Name	Phenyl-pa-M9:0 [5-phenylnonyl-N-methylpiperizinamide]
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	316.251463657 u
Formula	C20H32N2O
InChI	InChI=1S/C20H32N2O/c1-21-15-17-22(18-16-21)20(23)14-10-5-3-2-4-7-11-19-12-8-6-9-13-19/h6,8-9,12-13H,2-5,7,10-11,14-18H2,1H3
InChIKey	DMXKRHDBVOLHRU-UHFFFAOYSA-N
Molecular Weight	316.489 g/mol
SMILES	C(N1CCN(CC1)C)(=O)CCCCCCCCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR)	0.962023