6-{6-[11-(CARBOXYAMINO)UNDECANAMIDO]HEXANAMIDO}HEXANOIC ACID, BENZYL ESTER

SpectraBase Compound ID	GqLLtolAazh
InChI	InChI=1S/C31H51N3O6/c35-28(32-23-16-8-13-21-29(36)33-24-17-9-14-22-30(37)38)20-12-5-3-1-2-4-6-15-25-34-31(39)40-26-27-18-10-7-11-19-27/h7,10-11,18-19H,1-6,8-9,12-17,20-26H2,(H,32,35)(H,33,36)(H,34,39)(H,37,38)
InChIKey	INAUGXNZATUGMA-UHFFFAOYSA-N Google Search
Mol Weight	561.8 g/mol
Molecular Formula	C31H51N3O6
Exact Mass	561.377786 g/mol

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SpectraBase Spectrum ID	DGpgaqjLK5G
Name	6-{6-[11-(CARBOXYAMINO)UNDECANAMIDO]HEXANAMIDO}HEXANOIC ACID, BENZYL ESTER
Source of Sample	H. Zahn & W. Pieper, Technische Hochschule, Aachen, Germany
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C31H51N3O6
InChI	InChI=1S/C31H51N3O6/c35-28(32-23-16-8-13-21-29(36)33-24-17-9-14-22-30(37)38)20-12-5-3-1-2-4-6-15-25-34-31(39)40-26-27-18-10-7-11-19-27/h7,10-11,18-19H,1-6,8-9,12-17,20-26H2,(H,32,35)(H,33,36)(H,34,39)(H,37,38)
InChIKey	INAUGXNZATUGMA-UHFFFAOYSA-N
Literature Reference	Abstract-Chemical Abstracts= 57, 9660(1962)
Melting Point	125-126C
Molecular Weight	561.763977
Synonyms	HEXANOIC ACID, 6-/6-/11-/CARBOXY- AMINO/UNDECANAMIDO/HEXANAMIDO/-, BENZYL ESTER
Technique	KBr WAFER