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Diazo-(N-tosyl-L-phenylalanyl)methane
SpectraBase Compound ID P1Hj4scIX8
InChI InChI=1S/C17H17N3O3S/c1-13-7-9-15(10-8-13)24(22,23)20-16(17(21)12-19-18)11-14-5-3-2-4-6-14/h2-10,12,16,20H,11H2,1H3/t16-/m0/s1
InChIKey NAFSCPUMIXHGQP-INIZCTEOSA-N
Mol Weight 343.4 g/mol
Molecular Formula C17H17N3O3S
Exact Mass 343.099063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DOe1ToxhLsJ
Name Diazo-(N-tosyl-L-phenylalanyl)methane
Comments Computed using HOSE algorithm
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Exact Mass 343.099062590 u
Formula C17H17N3O3S
InChI InChI=1S/C17H17N3O3S/c1-13-7-9-15(10-8-13)24(22,23)20-16(17(21)12-19-18)11-14-5-3-2-4-6-14/h2-10,12,16,20H,11H2,1H3/t16-/m0/s1
InChIKey NAFSCPUMIXHGQP-INIZCTEOSA-N
Molecular Weight 343.401 g/mol
SMILES [C@](NS(C=1C=CC(=CC1)C)(=O)=O)(C(C=[N+]=[N-])=O)(CC1=CC=CC=C1)[H]