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Selenocyanic acid, heptadecyl ester
SpectraBase Compound ID HQxxdi0GrQv
InChI InChI=1S/C18H35NSe/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18-19/h2-17H2,1H3
InChIKey UKAQPXLAAIPXKG-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C18H35NSe
Exact Mass 345.193472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 39YeBCnZSOO
Name Selenocyanic acid, heptadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 345.193472131 u
Formula C18H35NSe
InChI InChI=1S/C18H35NSe/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18-19/h2-17H2,1H3
InChIKey UKAQPXLAAIPXKG-UHFFFAOYSA-N
Molecular Weight 344.457 g/mol
SMILES C(CCCC)CCCCCCCCCCCC[Se]C#N