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Methyl 2-diazo-3-(m-trifluoromethyl)phenyl-3-[(N-tosyl)amino]propanoate
SpectraBase Compound ID A7idtYVuD3w
InChI InChI=1S/C18H16F3N3O4S/c1-11-6-8-14(9-7-11)29(26,27)24-15(16(23-22)17(25)28-2)12-4-3-5-13(10-12)18(19,20)21/h3-10,15,24H,1-2H3
InChIKey ZCUBNOGLAMASNY-UHFFFAOYSA-N
Mol Weight 427.4 g/mol
Molecular Formula C18H16F3N3O4S
Exact Mass 427.081362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxiclnxixqL
Name Methyl 2-diazo-3-(m-trifluoromethyl)phenyl-3-[(N-tosyl)amino]propanoate
Alternate Name(s) Methyl 2-diazo-3-{[(4-methylphenyl)sulfonyl]amino}-3-[3-(trifluoromethyl)phenyl]propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16F3N3O4S
InChI InChI=1S/C18H16F3N3O4S/c1-11-6-8-14(9-7-11)29(26,27)24-15(16(23-22)17(25)28-2)12-4-3-5-13(10-12)18(19,20)21/h3-10,15,24H,1-2H3
InChIKey ZCUBNOGLAMASNY-UHFFFAOYSA-N
Molecular Weight 427.398 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(=[N+]=[N-])C(=O)OC)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0006-9700000000-9417b26ff2a591843ca9
Source of Spectrum KC-61-6549-3
Wiley ID 1629704