CID 24709583

2-{4h,5h,6h,7h-thieno[3,2-c]pyridin-5-yl}ethan-1-amine

Structural Information

Molecular Formula
C9H14N2S
SMILES
C1CN(CC2=C1SC=C2)CCN
InChI
InChI=1S/C9H14N2S/c10-3-5-11-4-1-9-8(7-11)2-6-12-9/h2,6H,1,3-5,7,10H2
InChIKey
ACEUGCSSOOSCHO-UHFFFAOYSA-N
Compound name
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

182.08777 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09505 137.2
[M+Na]+ 205.07699 144.7
[M-H]- 181.08049 139.7
[M+NH4]+ 200.12159 159.0
[M+K]+ 221.05093 141.5
[M+H-H2O]+ 165.08503 131.3
[M+HCOO]- 227.08597 153.7
[M+CH3COO]- 241.10162 149.9
[M+Na-2H]- 203.06244 139.8
[M]+ 182.08722 135.6
[M]- 182.08832 135.6
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

patents stripe