For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-[[2-[5-CHLORO-1-(PHENYLMETHYL)-1-H-1,2,3-TRIAZOL-4-YL]-2-OXOETHYL]-THIO]-N-PHENYLPROPANAMIDE
SpectraBase Compound ID LNHhlaapRKK
InChI InChI=1S/C20H19ClN4O2S/c21-20-19(23-24-25(20)13-15-7-3-1-4-8-15)17(26)14-28-12-11-18(27)22-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,22,27)
InChIKey VYRFLFZCYFQTPO-UHFFFAOYSA-N
Mol Weight 414.91 g/mol
Molecular Formula C20H19ClN4O2S
Exact Mass 414.091725 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Bvjwf6vQKKM
Name 3-[[2-[5-CHLORO-1-(PHENYLMETHYL)-1-H-1,2,3-TRIAZOL-4-YL]-2-OXOETHYL]-THIO]-N-PHENYLPROPANAMIDE
Compound Number 1 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19ClN4O2S
InChI InChI=1S/C20H19ClN4O2S/c21-20-19(23-24-25(20)13-15-7-3-1-4-8-15)17(26)14-28-12-11-18(27)22-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,22,27)
InChIKey VYRFLFZCYFQTPO-UHFFFAOYSA-N
Literature Reference Author T.M.CHAN,R.FRIARY,H.JONES,J.H.SCHWERDT,V.SEIDL,A.S.WATNICK,S .M.WILLIAMS
Literature Reference Citation J.HETCYCL.CHEM.,27,1135(1990)
Literature Reference DOI 10.1002/jhet.5570270462
Molecular Weight 414.909 g/mol
Solvent CDCl3
Source File Reference UWMZ1110