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5-(Cyclohexylcarbamoyl)-3-[(cyclohexylcarbamoyl)methyl]thiophene-2-carboxylic acid
SpectraBase Compound ID GEdwYEw9V0V
InChI InChI=1S/C20H28N2O4S/c23-17(21-14-7-3-1-4-8-14)12-13-11-16(27-18(13)20(25)26)19(24)22-15-9-5-2-6-10-15/h11,14-15H,1-10,12H2,(H,21,23)(H,22,24)(H,25,26)
InChIKey YQTUMHYBYAJHPZ-UHFFFAOYSA-N
Mol Weight 392.51 g/mol
Molecular Formula C20H28N2O4S
Exact Mass 392.176979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlkNH33WBBI
Name 5-(Cyclohexylcarbamoyl)-3-[(cyclohexylcarbamoyl)methyl]thiophene-2-carboxylic acid
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Formula C20H28N2O4S
InChI InChI=1S/C20H28N2O4S/c23-17(21-14-7-3-1-4-8-14)12-13-11-16(27-18(13)20(25)26)19(24)22-15-9-5-2-6-10-15/h11,14-15H,1-10,12H2,(H,21,23)(H,22,24)(H,25,26)
InChIKey YQTUMHYBYAJHPZ-UHFFFAOYSA-N
Molecular Weight 392.514 g/mol
SMILES N(C(c1sc(c(CC(NC2CCCCC2)=O)c1)C(=O)O)=O)C1CCCCC1
SPLASH splash10-01b9-1292000000-8e1ce6f1bf4221cdc298
Source of Spectrum F4-0-3097-26
Synonyms 5-[(cyclohexylamino)carbonyl]-3-[2-(cyclohexylamino)-2-oxoethyl]-2-thiophenecarboxylic acid
Wiley ID 1620647