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2-n-decylthioorotic acid hydrobromide
SpectraBase Compound ID 2AtJOELUZKV
InChI InChI=1S/C15H24N2O3S.BrH/c1-2-3-4-5-6-7-8-9-10-21-15-16-12(14(19)20)11-13(18)17-15;/h11H,2-10H2,1H3,(H,19,20)(H,16,17,18);1H
InChIKey XVFLNUSMXOOMAO-UHFFFAOYSA-N
Mol Weight 393.34 g/mol
Molecular Formula C15H25BrN2O3S
Exact Mass 392.076927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrU16VxkspU
Name 2-n-decylthioorotic acid hydrobromide
Alternate Name(s) 2-(decylsulfanyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylic acid hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25BrN2O3S
InChI InChI=1S/C15H24N2O3S.BrH/c1-2-3-4-5-6-7-8-9-10-21-15-16-12(14(19)20)11-13(18)17-15;/h11H,2-10H2,1H3,(H,19,20)(H,16,17,18);1H
InChIKey XVFLNUSMXOOMAO-UHFFFAOYSA-N
Molecular Weight 393.340 g/mol
SMILES Br.N1C(=NC(C(=O)O)=CC1=O)SCCCCCCCCCC
SPLASH splash10-014r-0093200000-2591ce3daed845d4a660
Source of Spectrum O-29-50-0
Wiley ID 1365571