SpectraBase Compound ID | 5A9nLbWrX0J |
---|---|
InChI | InChI=1S/C12H21N3O5S3/c1-3-14-10-8-15(5-4-6-20-2)23(18,19)12-9(10)7-11(21-12)22(13,16)17/h7,10,14H,3-6,8H2,1-2H3,(H2,13,16,17)/t10-/m0/s1 |
InChIKey | HCRKCZRJWPKOAR-JTQLQIEISA-N |
Mol Weight | 383.5 g/mol |
Molecular Formula | C12H21N3O5S3 |
Exact Mass | 383.064334 g/mol |
Enantiomer InChIKey | HCRKCZRJWPKOAR-SNVBAGLBSA-N |
Racemate InChIKey | HCRKCZRJWPKOAR-UHFFFAOYSA-N |
The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.
The NIST/EPA/NIH MS/MS 2020 libraries contain over 1,320,000 spectra for over 185,500 ions. The MS/MS libraries also contain metabolites, peptides (including biologically-relevant peptides), contaminants, lipids, and more. Learn more.
This library enables fast and reliable identification of the latest illegal designer drugs. It is updated annually. Learn more.
The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.
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