CID 11229071

2-amino-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Structural Information

Molecular Formula
C10H11N3
SMILES
C1CCC2=NC(=C(C=C2C1)C#N)N
InChI
InChI=1S/C10H11N3/c11-6-8-5-7-3-1-2-4-9(7)13-10(8)12/h5H,1-4H2,(H2,12,13)
InChIKey
ZBOFTCWMOSKYLC-UHFFFAOYSA-N
Compound name
2-amino-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

173.09529 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.10257 142.5
[M+Na]+ 196.08451 154.4
[M+NH4]+ 191.12911 148.2
[M+K]+ 212.05845 144.3
[M-H]- 172.08801 138.2
[M+Na-2H]- 194.06996 145.9
[M]+ 173.09474 142.1
[M]- 173.09584 142.1
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