CID 54592586

Methyl({[1-(pyridazin-3-yl)pyrrolidin-2-yl]methyl})amine dihydrobromide

Structural Information

Molecular Formula
C10H16N4
SMILES
CNCC1CCCN1C2=NN=CC=C2
InChI
InChI=1S/C10H16N4/c1-11-8-9-4-3-7-14(9)10-5-2-6-12-13-10/h2,5-6,9,11H,3-4,7-8H2,1H3
InChIKey
YUORAWUIGVUNLY-UHFFFAOYSA-N
Compound name
N-methyl-1-(1-pyridazin-3-ylpyrrolidin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.1375 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.14478 143.0
[M+Na]+ 215.12672 149.3
[M-H]- 191.13022 145.2
[M+NH4]+ 210.17132 159.7
[M+K]+ 231.10066 146.5
[M+H-H2O]+ 175.13476 133.5
[M+HCOO]- 237.13570 163.7
[M+CH3COO]- 251.15135 154.6
[M+Na-2H]- 213.11217 148.3
[M]+ 192.13695 139.8
[M]- 192.13805 139.8
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.