CID 42625544

Nos f-18

Structural Information

Molecular Formula

C₉H₁₃FN₂

SMILES

CC1=CC(=NC(=C1)N)CC(C)[18F]

InChI

InChI=1S/C9H13FN2/c1-6-3-8(5-7(2)10)12-9(11)4-6/h3-4,7H,5H2,1-2H3,(H2,11,12)/i10-1

InChIKey

MBHRCNFCHFHUKZ-LMANFOLPSA-N

Compound name

6-(2-(18F)fluoranylpropyl)-4-methylpyridin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 167.10881 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]+	168.11609	135.7
[M+Na]+	190.09803	147.2
[M+NH4]+	185.14263	143.5
[M+K]+	206.07197	141.3
[M-H]-	166.10153	136.6
[M+Na-2H]-	188.08348	141.6
[M]+	167.10826	137.4
[M]-	167.10936	137.4

Literature stripe

literature stripe

Patent stripe

patents stripe