CID 132344229

2137900-93-5

Structural Information

Molecular Formula
C13H19N3O4
SMILES
CC(C)(C)OC(=O)NC1CCN2C(=C(C=N2)C(=O)O)C1
InChI
InChI=1S/C13H19N3O4/c1-13(2,3)20-12(19)15-8-4-5-16-10(6-8)9(7-14-16)11(17)18/h7-8H,4-6H2,1-3H3,(H,15,19)(H,17,18)
InChIKey
USNKTGNHTHJVML-UHFFFAOYSA-N
Compound name
5-[(2-methylpropan-2-yl)oxycarbonylamino]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.13754 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.14482 164.9
[M+Na]+ 304.12676 170.5
[M-H]- 280.13026 165.2
[M+NH4]+ 299.17136 180.0
[M+K]+ 320.10070 169.1
[M+H-H2O]+ 264.13480 158.3
[M+HCOO]- 326.13574 180.4
[M+CH3COO]- 340.15139 198.5
[M+Na-2H]- 302.11221 167.4
[M]+ 281.13699 164.5
[M]- 281.13809 164.5
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

No patent data available for this compound.