CID 131407013

Methyl 3-methyl-2h,4h,5h,6h,7h-pyrazolo[4,3-c]pyridine-6-carboxylate hydrochloride

Structural Information

Molecular Formula
C9H13N3O2
SMILES
CC1=C2CNC(CC2=NN1)C(=O)OC
InChI
InChI=1S/C9H13N3O2/c1-5-6-4-10-8(9(13)14-2)3-7(6)12-11-5/h8,10H,3-4H2,1-2H3,(H,11,12)
InChIKey
WQMHTQSJRPBHPA-UHFFFAOYSA-N
Compound name
methyl 3-methyl-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.10077 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.108046 144.2
[M+Na]+ 218.089988 151.9
[M-H]- 194.093494 141.9
[M+NH4]+ 213.134593 161.2
[M+K]+ 234.063928 148.6
[M+H-H2O]+ 178.098030 137.0
[M+HCOO]- 240.098971 159.1
[M+CH3COO]- 254.114621 178.3
[M+Na-2H]- 216.075436 147.2
[M]+ 195.10022142 140.8
[M]- 195.10131858 140.8
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.