CID 50873898

4,5,6,7-tetrahydro-1-methyl-1h-pyrazolo[4,3-c]pyridine

Structural Information

Molecular Formula
C7H11N3
SMILES
CN1C2=C(CNCC2)C=N1
InChI
InChI=1S/C7H11N3/c1-10-7-2-3-8-4-6(7)5-9-10/h5,8H,2-4H2,1H3
InChIKey
QXSMCHPCLANISC-UHFFFAOYSA-N
Compound name
1-methyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

137.09529 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.10257 129.0
[M+Na]+ 160.08451 137.2
[M-H]- 136.08801 127.8
[M+NH4]+ 155.12911 148.9
[M+K]+ 176.05845 134.4
[M+H-H2O]+ 120.09255 121.5
[M+HCOO]- 182.09349 146.5
[M+CH3COO]- 196.10914 141.4
[M+Na-2H]- 158.06996 135.3
[M]+ 137.09474 124.9
[M]- 137.09584 124.9
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