CID 18993881

(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CCC2=C(C1)C=CC(=C2)CN

InChI

InChI=1S/C11H15N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h5-7H,1-4,8,12H2

InChIKey

SGCPAUPWLDLCBN-UHFFFAOYSA-N

Compound name

5,6,7,8-tetrahydronaphthalen-2-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 161.12045 Da
Monoisotopic Mass: 2.2
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]+	162.12773	133.7
[M+Na]+	184.10967	139.8
[M-H]-	160.11317	137.2
[M+NH4]+	179.15427	155.1
[M+K]+	200.08361	136.6
[M+H-H2O]+	144.11771	127.8
[M+HCOO]-	206.11865	155.1
[M+CH3COO]-	220.13430	180.7
[M+Na-2H]-	182.09512	140.8
[M]+	161.11990	128.9
[M]-	161.12100	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe