CID 16770270

2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)propan-1-amine

Structural Information

Molecular Formula
C13H20N2
SMILES
CC(C)(CN)N1CCC2=CC=CC=C2C1
InChI
InChI=1S/C13H20N2/c1-13(2,10-14)15-8-7-11-5-3-4-6-12(11)9-15/h3-6H,7-10,14H2,1-2H3
InChIKey
RUZNMAAWLDJWOC-UHFFFAOYSA-N
Compound name
2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

204.16264 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.16992 148.7
[M+Na]+ 227.15186 154.3
[M-H]- 203.15536 150.6
[M+NH4]+ 222.19646 167.0
[M+K]+ 243.12580 150.9
[M+H-H2O]+ 187.15990 141.9
[M+HCOO]- 249.16084 166.4
[M+CH3COO]- 263.17649 189.8
[M+Na-2H]- 225.13731 155.3
[M]+ 204.16209 144.6
[M]- 204.16319 144.6
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