CID 15718632

129280-17-7

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CC2=CC=CC=C2CC1CN

InChI

InChI=1S/C11H15N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-4,9H,5-8,12H2

InChIKey

WKQAFPKAFXIRCK-UHFFFAOYSA-N

Compound name

1,2,3,4-tetrahydronaphthalen-2-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 67
Patents: 161.12045 Da
Monoisotopic Mass: 1.9
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]+	162.127726	133.7
[M+Na]+	184.109668	139.8
[M-H]-	160.113174	137.2
[M+NH4]+	179.154273	155.1
[M+K]+	200.083608	136.6
[M+H-H2O]+	144.117710	127.8
[M+HCOO]-	206.118651	155.1
[M+CH3COO]-	220.134301	180.7
[M+Na-2H]-	182.095116	140.8
[M]+	161.11990142	128.9
[M]-	161.12099858	128.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe