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

*Links on SpectraBase are not permalinks.
2-(2,4-dichlorophenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfinyl]-3-(1,2,4-triazol-1-yl)propan-2-ol
SpectraBase Compound ID DOvFhYivqCV
InChI InChI=1S/C17H18Cl2N4O3S/c1-11-14(12(2)26-22-11)6-27(25)8-17(24,7-23-10-20-9-21-23)15-4-3-13(18)5-16(15)19/h3-5,9-10,24H,6-8H2,1-2H3
InChIKey KLQTWXVSDZIVOQ-UHFFFAOYSA-N
Mol Weight 429.32 g/mol
Molecular Formula C17H18Cl2N4O3S
Exact Mass 428.047667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID EwdbjNB9g6z
Name 2-(2,4-dichlorophenyl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfinyl]-3-(1,2,4-triazol-1-yl)propan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18Cl2N4O3S
InChI InChI=1S/C17H18Cl2N4O3S/c1-11-14(12(2)26-22-11)6-27(25)8-17(24,7-23-10-20-9-21-23)15-4-3-13(18)5-16(15)19/h3-5,9-10,24H,6-8H2,1-2H3
InChIKey KLQTWXVSDZIVOQ-UHFFFAOYSA-N
Molecular Weight 429.322 g/mol
SMILES OC(CS(Cc1c(onc1C)C)=O)(c1c(cc(cc1)Cl)Cl)C[n]1ncnc1
SPLASH splash10-03xr-5900000000-ee1efb0cbb453d9226ea
Source of Spectrum Y-29-1560-17
Synonyms 2-(2,4-dichlorophenyl)-1-[(3,5-dimethyl-4-isoxazolyl)methylsulfinyl]-3-(1,2,4-triazol-1-yl)-2-propanol 2-(2,4-dichlorophenyl)-1-[(3,5-dimethylisoxazol-4-yl)methylsulfinyl]-3-(1,2,4-triazol-1-yl)propan-2-ol
Wiley ID 1380541