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

*Links on SpectraBase are not permalinks.

2-[[3-(2,6-Dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]-hydroxymethylidene]propanedinitrile

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-[[3-(2,6-Dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]-hydroxymethylidene]propanedinitrile
SpectraBase Compound ID FDWFlMwRGkE
InChI InChI=1S/C14H7Cl2N3O2/c1-7-11(14(20)8(5-17)6-18)13(19-21-7)12-9(15)3-2-4-10(12)16/h2-4,20H,1H3
InChIKey KMDCBMRZVBZGCH-UHFFFAOYSA-N
Mol Weight 320.14 g/mol
Molecular Formula C14H7Cl2N3O2
Exact Mass 318.991532 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 1EhS6MvUXNb
Name 2-[[3-(2,6-Dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]-hydroxymethylidene]propanedinitrile
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.991531875 u
Formula C14H7Cl2N3O2
InChI InChI=1S/C14H7Cl2N3O2/c1-7-11(14(20)8(5-17)6-18)13(19-21-7)12-9(15)3-2-4-10(12)16/h2-4,20H,1H3
InChIKey KMDCBMRZVBZGCH-UHFFFAOYSA-N
Molecular Weight 320.135 g/mol
SMILES C=1(C(=NOC1C)C1=C(Cl)C=CC=C1Cl)C(=C(C#N)C#N)O