CID 53991954

(1,2,3,4-tetrahydroisoquinolin-5-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C10H14N2
SMILES
C1CNCC2=C1C(=CC=C2)CN
InChI
InChI=1S/C10H14N2/c11-6-8-2-1-3-9-7-12-5-4-10(8)9/h1-3,12H,4-7,11H2
InChIKey
KFMLTYWCWVYQIL-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydroisoquinolin-5-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.11569 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.122966 134.3
[M+Na]+ 185.104908 140.4
[M-H]- 161.108414 135.0
[M+NH4]+ 180.149513 153.5
[M+K]+ 201.078848 136.4
[M+H-H2O]+ 145.112950 127.8
[M+HCOO]- 207.113891 153.2
[M+CH3COO]- 221.129541 146.1
[M+Na-2H]- 183.090356 141.5
[M]+ 162.11514142 127.8
[M]- 162.11623858 127.8
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.