CID 16793215

893758-48-0

Structural Information

Molecular Formula
C11H17N3OS
SMILES
CCCN1CCC2=C(C1)SC(=C2C(=O)N)N
InChI
InChI=1S/C11H17N3OS/c1-2-4-14-5-3-7-8(6-14)16-11(13)9(7)10(12)15/h2-6,13H2,1H3,(H2,12,15)
InChIKey
AUEVEUXXTNLXSB-UHFFFAOYSA-N
Compound name
2-amino-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.10924 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.11652 152.9
[M+Na]+ 262.09846 160.8
[M+NH4]+ 257.14306 160.7
[M+K]+ 278.07240 155.8
[M-H]- 238.10196 154.6
[M+Na-2H]- 260.08391 154.7
[M]+ 239.10869 154.5
[M]- 239.10979 154.5
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.