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D-Desthiobiotin
SpectraBase Compound ID Jm1hklpLDMY
InChI InChI=1S/C10H18N2O3/c1-7-8(12-10(15)11-7)5-3-2-4-6-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H2,11,12,15)/t7-,8+/m0/s1
InChIKey AUTOLBMXDDTRRT-JGVFFNPUSA-N
Mol Weight 214.26 g/mol
Molecular Formula C10H18N2O3
Exact Mass 214.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RERLO4G2Em
Name 4-Imidazolidinehexanoic acid, 5-methyl-2-oxo-, (4R,5S)-
CAS Registry Number 533-48-2
Comments Less than 3 mono-isotopic peaks
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Formula C10H18N2O3
InChI InChI=1S/C10H18N2O3/c1-7-8(12-10(15)11-7)5-3-2-4-6-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H2,11,12,15)/t7-,8+/m0/s1
InChIKey AUTOLBMXDDTRRT-JGVFFNPUSA-N
Molecular Weight 214.265 g/mol
SMILES N1[C@]([C@@](CCCCCC(=O)O)(NC1=O)[H])(C)[H]
SPLASH splash10-00di-9000000000-15af8d92d3b897bc8f3f
Source of Spectrum KO-7-188-2
Synonyms 4-Imidazolidinehexanoic acid, 5-methyl-2-oxo-, (4R-cis)- (+)-Dethiobiotin (4R-cis)-5-methyl-2-oxoimidazolidine-4-hexanoic acid 4-Methyl-5-(omega-carboxyamyl)imidazolidone-2 5-Methyl-2-oxo-4-imidazolidinecaproic acid 5-Methyl-2-oxo-4-imidazolidinehexanoic acid 6-[(4R,5S)-2-keto-5-methyl-imidazolidin-4-yl]hexanoic acid 6-[(4R,5S)-5-methyl-2-oxidanylidene-imidazolidin-4-yl]hexanoic acid 6-[(4R,5S)-5-methyl-2-oxo-4-imidazolidinyl]hexanoic acid 6-[(4R,5S)-5-methyl-2-oxo-imidazolidin-4-yl]hexanoic acid Biotin, dethio- D-dethiobiotin Desthiobiotin Dethiobiotin Epsilon-(4-methyl-5-imidazolidone-2)caproic acid AI3-26390 EINECS 208-566-2
Wiley ID 1213255