CID 96855843

(2s)-2-{5h,6h,7h,8h-[1,2,4]triazolo[4,3-a]pyridin-3-yl}pyrrolidine dihydrochloride

Structural Information

Molecular Formula
C10H16N4
SMILES
C1CCN2C(=NN=C2[C@@H]3CCCN3)C1
InChI
InChI=1S/C10H16N4/c1-2-7-14-9(5-1)12-13-10(14)8-4-3-6-11-8/h8,11H,1-7H2/t8-/m0/s1
InChIKey
SRNJTVMJFGYBPH-QMMMGPOBSA-N
Compound name
3-[(2S)-pyrrolidin-2-yl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.1375 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.14478 144.7
[M+Na]+ 215.12672 154.6
[M+NH4]+ 210.17132 152.7
[M+K]+ 231.10066 152.4
[M-H]- 191.13022 145.6
[M+Na-2H]- 213.11217 148.8
[M]+ 192.13695 146.0
[M]- 192.13805 146.0
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.

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No patent data available for this compound.