(S)-2-[11-(Azacyclotridecane-2-ylideneamino)-undecyl]-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxylic Acid

SpectraBase Compound ID	I3513iZ13mf
InChI	InChI=1S/C28H51N3O3/c1-24-27(28(32)33)31-26(34-24)21-17-13-9-5-3-7-11-15-19-23-30-25-20-16-12-8-4-2-6-10-14-18-22-29-25/h24,27H,2-23H2,1H3,(H,29,30)(H,32,33)/t24-,27?/m0/s1
InChIKey	LWEMGNOIVXAJDH-BXXZMZEQSA-N Google Search
Mol Weight	477.7 g/mol
Molecular Formula	C28H51N3O3
Exact Mass	477.393043 g/mol

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SpectraBase Spectrum ID	17aqsmjFXlJ
Name	(S)-2-[11-(Azacyclotridecane-2-ylideneamino)-undecyl]-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxylic Acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C28H51N3O3
InChI	InChI=1S/C28H51N3O3/c1-24-27(28(32)33)31-26(34-24)21-17-13-9-5-3-7-11-15-19-23-30-25-20-16-12-8-4-2-6-10-14-18-22-29-25/h24,27H,2-23H2,1H3,(H,29,30)(H,32,33)/t24-,27?/m0/s1
InChIKey	LWEMGNOIVXAJDH-BXXZMZEQSA-N
Literature Reference DOI	10.1002/prac.199533701117
Molecular Weight	477.734 g/mol
SMILES	OC(C1[C@@](OC(CCCCCCCCCCCN=C2NCCCCCCCCCCC2)=N1)(C)[H])=O
SPLASH	splash10-067i-9000000000-213d7a053467745adc61
Source of Spectrum	JF-337-556-14p
Synonyms	(5S)-2-(11-((azacyclotridecan-2-ylidene)amino)undecyl)-5-methyl-4,5-dihydrooxazole-4-carboxylic acid
Wiley ID	1789938