CID 165468415

En300-1586581

Structural Information

Molecular Formula
C14H16FN3O
SMILES
COC1=C(C=C(C=C1)C2CCCN3C2=CC(=N3)N)F
InChI
InChI=1S/C14H16FN3O/c1-19-13-5-4-9(7-11(13)15)10-3-2-6-18-12(10)8-14(16)17-18/h4-5,7-8,10H,2-3,6H2,1H3,(H2,16,17)
InChIKey
GFAQDOHAYIIFMU-UHFFFAOYSA-N
Compound name
4-(3-fluoro-4-methoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.12775 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.13503 158.6
[M+Na]+ 284.11697 167.4
[M-H]- 260.12047 162.1
[M+NH4]+ 279.16157 175.3
[M+K]+ 300.09091 162.6
[M+H-H2O]+ 244.12501 149.2
[M+HCOO]- 306.12595 177.6
[M+CH3COO]- 320.14160 170.0
[M+Na-2H]- 282.10242 161.0
[M]+ 261.12720 155.8
[M]- 261.12830 155.8
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.