CID 123203

Dimethylaminosulfur trifluoride

Structural Information

Molecular Formula
C2H6F3NS
SMILES
CN(C)S(F)(F)F
InChI
InChI=1S/C2H6F3NS/c1-6(2)7(3,4)5/h1-2H3
InChIKey
SAVQQRYWWAGSQW-UHFFFAOYSA-N
Compound name
N-methyl-N-(trifluoro-lambda4-sulfanyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1761
Patents

133.0173 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.02458 127.0
[M+Na]+ 156.00652 133.9
[M+NH4]+ 151.05112 133.6
[M+K]+ 171.98046 128.4
[M-H]- 132.01002 123.2
[M+Na-2H]- 153.99197 129.2
[M]+ 133.01675 127.0
[M]- 133.01785 127.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe