CID 115011510

2172561-42-9

Structural Information

Molecular Formula
C6H10FN3
SMILES
CCN1C(=C(C=N1)CN)F
InChI
InChI=1S/C6H10FN3/c1-2-10-6(7)5(3-8)4-9-10/h4H,2-3,8H2,1H3
InChIKey
VEMCPAZGYLFABU-UHFFFAOYSA-N
Compound name
(1-ethyl-5-fluoropyrazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.08588 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.09316 127.0
[M+Na]+ 166.07510 136.7
[M-H]- 142.07860 126.7
[M+NH4]+ 161.11970 147.6
[M+K]+ 182.04904 134.7
[M+H-H2O]+ 126.08314 119.3
[M+HCOO]- 188.08408 150.0
[M+CH3COO]- 202.09973 176.8
[M+Na-2H]- 164.06055 131.7
[M]+ 143.08533 125.4
[M]- 143.08643 125.4
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.