1,4-Bis[N,N'-(butylaminocarbonyl)aminomethyl]benzene

SpectraBase Compound ID	DdS5anUmRtv
InChI	InChI=1S/C18H30N4O2/c1-3-5-11-19-17(23)21-13-15-7-9-16(10-8-15)14-22-18(24)20-12-6-4-2/h7-10H,3-6,11-14H2,1-2H3,(H2,19,21,23)(H2,20,22,24)
InChIKey	HHSKJVRJIFJZQH-UHFFFAOYSA-N Google Search
Mol Weight	334.46 g/mol
Molecular Formula	C18H30N4O2
Exact Mass	334.236876 g/mol

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SpectraBase Spectrum ID	D50SIIOiRYZ
Name	1,4-bis[N,N'-(Butylaminocarbonyl)aminomethyl]benzene
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	334.236876220 u
Formula	C18H30N4O2
InChI	InChI=1S/C18H30N4O2/c1-3-5-11-19-17(23)21-13-15-7-9-16(10-8-15)14-22-18(24)20-12-6-4-2/h7-10H,3-6,11-14H2,1-2H3,(H2,19,21,23)(H2,20,22,24)
InChIKey	HHSKJVRJIFJZQH-UHFFFAOYSA-N
Molecular Weight	334.464 g/mol
SMILES	C(NCC=1C=CC(CNC(=O)NCCCC)=CC1)(=O)NCCCC
Spectrum/Structure Validation Score (Vapor Phase IR)	0.9003