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(Z)-4-Chloro-N-isopropoxybenzimidic 4-methylbenzenesulfonic anhydride
SpectraBase Compound ID 8EaEwuY5blG
InChI InChI=1S/C17H18ClNO4S/c1-12(2)22-19-17(14-6-8-15(18)9-7-14)23-24(20,21)16-10-4-13(3)5-11-16/h4-12H,1-3H3/b19-17-
InChIKey VCEYSZIWWLYVKA-ZPHPHTNESA-N
Mol Weight 367.85 g/mol
Molecular Formula C17H18ClNO4S
Exact Mass 367.064507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0aDGtlHv4w
Name (Z)-4-Chloro-N-isopropoxybenzimidic 4-methylbenzenesulfonic anhydride
Appearance Yellowish crystalline solid
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Exact Mass 367.064506934 u
Formula C17H18ClNO4S
InChI InChI=1S/C17H18ClNO4S/c1-12(2)22-19-17(14-6-8-15(18)9-7-14)23-24(20,21)16-10-4-13(3)5-11-16/h4-12H,1-3H3/b19-17-
InChIKey VCEYSZIWWLYVKA-ZPHPHTNESA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/jo400179u
Molecular Weight 367.847 g/mol
Quality 5
SMILES C(O\N=C\(C1=CC=C(C=C1)Cl)OS(C1=CC=C(C=C1)C)(=O)=O)(C)C
SPLASH splash10-000i-0900000000-d378aac488dd1cb05154
Source of Spectrum JOC-78-3684-4i (DOI: 10.1021/jo400179u)
Wiley ID 1912516