CID 67870

402-38-0

Structural Information

Molecular Formula
C9H10F3N3
SMILES
CN(C)N=NC1=CC=CC(=C1)C(F)(F)F
InChI
InChI=1S/C9H10F3N3/c1-15(2)14-13-8-5-3-4-7(6-8)9(10,11)12/h3-6H,1-2H3
InChIKey
LYDULXUBCSVHIU-UHFFFAOYSA-N
Compound name
N-methyl-N-[[3-(trifluoromethyl)phenyl]diazenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.08269 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.08997 145.5
[M+Na]+ 240.07191 153.6
[M+NH4]+ 235.11651 151.6
[M+K]+ 256.04585 148.4
[M-H]- 216.07541 145.1
[M+Na-2H]- 238.05736 151.4
[M]+ 217.08214 146.2
[M]- 217.08324 146.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.