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Nicotinamide TMS
SpectraBase Compound ID 3TwrtUul5av
InChI InChI=1S/C9H14N2OSi/c1-13(2,3)11-9(12)8-5-4-6-10-7-8/h4-7H,1-3H3,(H,11,12)
InChIKey VQRBOHGTTOAYTJ-UHFFFAOYSA-N
Mol Weight 194.31 g/mol
Molecular Formula C9H14N2OSi
Exact Mass 194.08754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hnffZggBtd
Name Nicotinamide, 1TMS
Comments Derivatization type: 1 TMS (mass: 194.088); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000412; Note: The molecular formula of the structure shown is C6H6N2O - which differs from the formula reported for the mass spectrum (C9H14N2OSi)
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Formula C9H14N2OSi
InChI InChI=1S/C9H14N2OSi/c1-13(2,3)11-9(12)8-5-4-6-10-7-8/h4-7H,1-3H3,(H,11,12)
InChIKey VQRBOHGTTOAYTJ-UHFFFAOYSA-N
Molecular Weight 194.309 g/mol
SMILES N(C(c1cccnc1)=O)[Si](C)(C)C
SPLASH splash10-004i-0900000000-5fbe86ec9b07a9f63e8f
Source of Spectrum FM-2019-412-0
Synonyms Niacinamide, 1TMS vitamin PP, 1TMS Aminicotin, 1TMS Amixicotyn, 1TMS 3-Pyridinecarboxamide, 1TMS Pyridine-3-carboxamide, 1TMS N-(trimethylsilyl)nicotinamide
Wiley ID 1818099