CID 53385549

N-ethyl-5-fluoropyrimidin-2-amine

Structural Information

Molecular Formula
C6H8FN3
SMILES
CCNC1=NC=C(C=N1)F
InChI
InChI=1S/C6H8FN3/c1-2-8-6-9-3-5(7)4-10-6/h3-4H,2H2,1H3,(H,8,9,10)
InChIKey
SGAGTLALNMXHSE-UHFFFAOYSA-N
Compound name
N-ethyl-5-fluoropyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

141.07022 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.07750 125.6
[M+Na]+ 164.05944 134.5
[M-H]- 140.06294 125.5
[M+NH4]+ 159.10404 144.4
[M+K]+ 180.03338 132.5
[M+H-H2O]+ 124.06748 117.5
[M+HCOO]- 186.06842 148.5
[M+CH3COO]- 200.08407 176.2
[M+Na-2H]- 162.04489 134.6
[M]+ 141.06967 124.0
[M]- 141.07077 124.0
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