N-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide

enlarge

Systematic / IUPAC Name: N-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-methylthiadiazole-5-carboxamide

ID: Reference5978

Other Names: N-[(6-Fluoro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide;
1,2,3-Thiadiazole-5-carboxamide, N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-methyl-

Formula: C13H12FN3O3S

Spectral Data

N-[(6-Fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 149
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/15/2016 9:17:26 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C13H12FN3O3S/c1-7-12(21-17-16-7)13(18)15-4-8-2-10(14)3-9-5-19-6-20-11(8)9/h2-3H,4-6H2,1H3,(H,15,18)
InChI Key WBFSQHJOZIVRPP-UHFFFAOYSA-N
Canonical SMILES CC1=C(SN=N1)C(=O)NCC2=C3C(=CC(=C2)F)COCO3
CAS
Splash
Other Names N-[(6-Fluoro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide;
1,2,3-Thiadiazole-5-carboxamide, N-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-methyl-

In Other Databases

PubChem 2811100
ChemSpider 2089514