CID 91654349

1803589-88-9

Structural Information

Molecular Formula
C11H13N3
SMILES
CCCN1C(=CC=N1)C2=CC=NC=C2
InChI
InChI=1S/C11H13N3/c1-2-9-14-11(5-8-13-14)10-3-6-12-7-4-10/h3-8H,2,9H2,1H3
InChIKey
QVKPQFSAGDVMDU-UHFFFAOYSA-N
Compound name
4-(2-propylpyrazol-3-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.11095 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.11823 140.6
[M+Na]+ 210.10017 149.5
[M-H]- 186.10367 143.4
[M+NH4]+ 205.14477 158.0
[M+K]+ 226.07411 146.1
[M+H-H2O]+ 170.10821 131.5
[M+HCOO]- 232.10915 162.8
[M+CH3COO]- 246.12480 153.5
[M+Na-2H]- 208.08562 146.9
[M]+ 187.11040 141.3
[M]- 187.11150 141.3
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

No patent data available for this compound.