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1-butyl-2-[(1-butyl-4-formyl-2-imidazolyl)disulfanyl]-4-imidazolecarboxaldehyde
SpectraBase Compound ID 205qKQnF1iI
InChI InChI=1S/C16H22N4O2S2/c1-3-5-7-19-9-13(11-21)17-15(19)23-24-16-18-14(12-22)10-20(16)8-6-4-2/h9-12H,3-8H2,1-2H3
InChIKey YZJGWZPUGKGVNU-UHFFFAOYSA-N
Mol Weight 366.5 g/mol
Molecular Formula C16H22N4O2S2
Exact Mass 366.118418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jNvOGhXWXt
Name 1-butyl-2-[(1-butyl-4-formyl-2-imidazolyl)disulfanyl]-4-imidazolecarboxaldehyde
Alternate Name(s) 1-butyl-2-[(1-butyl-4-formyl-imidazol-2-yl)disulfanyl]imidazole-4-carbaldehyde 1-butyl-2-[(1-butyl-4-methanoyl-imidazol-2-yl)disulfanyl]imidazole-4-carbaldehyde
CAS Registry Number 123540-53-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N4O2S2
InChI InChI=1S/C16H22N4O2S2/c1-3-5-7-19-9-13(11-21)17-15(19)23-24-16-18-14(12-22)10-20(16)8-6-4-2/h9-12H,3-8H2,1-2H3
InChIKey YZJGWZPUGKGVNU-UHFFFAOYSA-N
Molecular Weight 366.498 g/mol
SMILES c1(nc(C=O)c[n]1CCCC)SSc1nc(C=O)c[n]1CCCC
SPLASH splash10-0udi-0900000000-5ef9cf0b20fefcdf08e2
Source of Spectrum J-55-752-2
Wiley ID 1351714