CID 12999506

14097-40-6

Structural Information

Molecular Formula

C₁₀H₁₄N₂

SMILES

CN1CCC2=C(C1)C=C(C=C2)N

InChI

InChI=1S/C10H14N2/c1-12-5-4-8-2-3-10(11)6-9(8)7-12/h2-3,6H,4-5,7,11H2,1H3

InChIKey

VRKLIVSHUQSRNF-UHFFFAOYSA-N

Compound name

2-methyl-3,4-dihydro-1H-isoquinolin-7-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 243
Patents: 162.11569 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	163.12297	134.2
[M+Na]+	185.10491	147.1
[M+NH4]+	180.14951	144.1
[M+K]+	201.07885	139.9
[M-H]-	161.10841	137.8
[M+Na-2H]-	183.09036	140.8
[M]+	162.11514	137.0
[M]-	162.11624	137.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe