(R)-2-[11-(Azacyclotridecane-2-ylideneamino)-undecyl]-5,5-dimethyl-4,5-dihydro-1,3-thiazole-4-carboxylic acid

SpectraBase Compound ID	KvVzDmY9wCO
InChI	InChI=1S/C29H53N3O2S/c1-29(2)27(28(33)34)32-26(35-29)22-18-14-10-6-4-8-12-16-20-24-31-25-21-17-13-9-5-3-7-11-15-19-23-30-25/h27H,3-24H2,1-2H3,(H,30,31)(H,33,34)/t27-/m1/s1
InChIKey	KEQQCSVVEBUAHU-HHHXNRCGSA-N Google Search
Mol Weight	507.8 g/mol
Molecular Formula	C29H53N3O2S
Exact Mass	507.385849 g/mol

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SpectraBase Spectrum ID	ck9eE5HOId
Name	(R)-2-[11-(Azacyclotridecane-2-ylideneamino)-undecyl]-5,5-dimethyl-4,5-dihydro-1,3-thiazole-4-carboxylic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H53N3O2S
InChI	InChI=1S/C29H53N3O2S/c1-29(2)27(28(33)34)32-26(35-29)22-18-14-10-6-4-8-12-16-20-24-31-25-21-17-13-9-5-3-7-11-15-19-23-30-25/h27H,3-24H2,1-2H3,(H,30,31)(H,33,34)/t27-/m1/s1
InChIKey	KEQQCSVVEBUAHU-HHHXNRCGSA-N
Literature Reference DOI	10.1002/prac.199533701117
Molecular Weight	507.822 g/mol
SMILES	OC([C@@]1(C(SC(CCCCCCCCCCCN=C2NCCCCCCCCCCC2)=N1)(C)C)[H])=O
SPLASH	splash10-000x-9000000000-e09b3b899868f6532884
Source of Spectrum	JF-337-556-14h
Synonyms	(R)-2-(11-((azacyclotridecan-2-ylidene)amino)undecyl)-5,5-dimethyl-4,5-dihydrothiazole-4-carboxylic acid
Wiley ID	1789934