CID 20631527

1919023-05-4

Structural Information

Molecular Formula
C8H9FN2
SMILES
CC1=CC(=C(C=C1)C(=N)N)F
InChI
InChI=1S/C8H9FN2/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H3,10,11)
InChIKey
TXWSYLYMSXTMSG-UHFFFAOYSA-N
Compound name
2-fluoro-4-methylbenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

98
Patents

152.07498 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.082256 129.2
[M+Na]+ 175.064198 137.4
[M-H]- 151.067704 131.8
[M+NH4]+ 170.108803 149.9
[M+K]+ 191.038138 134.7
[M+H-H2O]+ 135.072240 122.8
[M+HCOO]- 197.073181 153.7
[M+CH3COO]- 211.088831 182.3
[M+Na-2H]- 173.049646 134.2
[M]+ 152.07443142 124.5
[M]- 152.07552858 124.5
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