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2-(N-Butylamino)-3-imidazolyl-propanoic acid

View entire compound with spectra: 1 MS (GC)

2-(N-Butylamino)-3-imidazolyl-propanoic acid
SpectraBase Compound ID 4ZIlhX83H1w
InChI InChI=1S/C10H17N3O2/c1-2-3-4-11-8(10(14)15)7-9-12-5-6-13-9/h5-6,8,11H,2-4,7H2,1H3,(H,12,13)(H,14,15)
InChIKey QDDNBZALDSHNEW-UHFFFAOYSA-N
Mol Weight 211.27 g/mol
Molecular Formula C10H17N3O2
Exact Mass 211.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DyKnMIOLsU
Name 2-(N-Butylamino)-3-imidazolyl-propanoic acid
Alternate Name(s) N-butyl-3-(1H-imidazol-2-yl)alanine
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Formula C10H17N3O2
InChI InChI=1S/C10H17N3O2/c1-2-3-4-11-8(10(14)15)7-9-12-5-6-13-9/h5-6,8,11H,2-4,7H2,1H3,(H,12,13)(H,14,15)
InChIKey QDDNBZALDSHNEW-UHFFFAOYSA-N
Molecular Weight 211.265 g/mol
SMILES OC(C(Cc1ncc[nH]1)NCCCC)=O
SPLASH splash10-001i-9200000000-519c19f6595389d22c04
Source of Spectrum I-80-783-6
Wiley ID 1517204