CID 136575570

2209090-51-5

Structural Information

Molecular Formula

C₇H₁₅N₃

SMILES

CNCCC1=NCCN1C

InChI

InChI=1S/C7H15N3/c1-8-4-3-7-9-5-6-10(7)2/h8H,3-6H2,1-2H3

InChIKey

IAXYGVBHGJKGJV-UHFFFAOYSA-N

Compound name

N-methyl-2-(1-methyl-4,5-dihydroimidazol-2-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 141.1266 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]+	142.133876	131.2
[M+Na]+	164.115818	138.4
[M-H]-	140.119324	131.9
[M+NH4]+	159.160423	151.8
[M+K]+	180.089758	137.3
[M+H-H2O]+	124.123860	123.9
[M+HCOO]-	186.124801	154.1
[M+CH3COO]-	200.140451	177.1
[M+Na-2H]-	162.101266	136.7
[M]+	141.12605142	130.3
[M]-	141.12714858	130.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.