Ethyl 4-[3-(dibenzylamino)-1-heptynyl]benzoate

SpectraBase Compound ID	IL1PclcBHlW
InChI	InChI=1S/C30H33NO2/c1-3-5-16-29(22-19-25-17-20-28(21-18-25)30(32)33-4-2)31(23-26-12-8-6-9-13-26)24-27-14-10-7-11-15-27/h6-15,17-18,20-21,29H,3-5,16,23-24H2,1-2H3
InChIKey	LPONMFAJQRIVBL-UHFFFAOYSA-N Google Search
Mol Weight	439.6 g/mol
Molecular Formula	C30H33NO2
Exact Mass	439.251129 g/mol

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SpectraBase Spectrum ID	KAaccTfoZLr
Name	Ethyl 4-[3-(dibenzylamino)-1-heptynyl]benzoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C30H33NO2
InChI	InChI=1S/C30H33NO2/c1-3-5-16-29(22-19-25-17-20-28(21-18-25)30(32)33-4-2)31(23-26-12-8-6-9-13-26)24-27-14-10-7-11-15-27/h6-15,17-18,20-21,29H,3-5,16,23-24H2,1-2H3
InChIKey	LPONMFAJQRIVBL-UHFFFAOYSA-N
Molecular Weight	439.599 g/mol
SMILES	C(c1ccc(cc1)C#CC(CCCC)N(Cc1ccccc1)Cc1ccccc1)(=O)OCC
SPLASH	splash10-001i-3009000000-6e5e7323e368327182e2
Source of Spectrum	KC-61-11423-6
Wiley ID	1631432