CID 28430022

N-(thiophen-3-ylmethyl)pyridin-3-amine

Structural Information

Molecular Formula
C10H10N2S
SMILES
C1=CC(=CN=C1)NCC2=CSC=C2
InChI
InChI=1S/C10H10N2S/c1-2-10(7-11-4-1)12-6-9-3-5-13-8-9/h1-5,7-8,12H,6H2
InChIKey
KWFURRGBEZMQCO-UHFFFAOYSA-N
Compound name
N-(thiophen-3-ylmethyl)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.05647 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.063746 137.5
[M+Na]+ 213.045688 145.9
[M-H]- 189.049194 143.4
[M+NH4]+ 208.090293 157.9
[M+K]+ 229.019628 142.2
[M+H-H2O]+ 173.053730 130.5
[M+HCOO]- 235.054671 158.9
[M+CH3COO]- 249.070321 151.2
[M+Na-2H]- 211.031136 142.5
[M]+ 190.05592142 138.3
[M]- 190.05701858 138.3
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.