CID 132349386

2137822-96-7

Structural Information

Molecular Formula
C5H7F2N3
SMILES
CN1C(=CC(=N1)N)C(F)F
InChI
InChI=1S/C5H7F2N3/c1-10-3(5(6)7)2-4(8)9-10/h2,5H,1H3,(H2,8,9)
InChIKey
BBZOBRKRSYLFLK-UHFFFAOYSA-N
Compound name
5-(difluoromethyl)-1-methylpyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

147.0608 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.068076 125.0
[M+Na]+ 170.050018 134.9
[M-H]- 146.053524 123.7
[M+NH4]+ 165.094623 145.3
[M+K]+ 186.023958 133.2
[M+H-H2O]+ 130.058060 116.7
[M+HCOO]- 192.059001 146.3
[M+CH3COO]- 206.074651 177.4
[M+Na-2H]- 168.035466 128.5
[M]+ 147.06025142 121.3
[M]- 147.06134858 121.3
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

patents stripe