CID 16641495

Cyclopropyl(1-methyl-1h-imidazol-2-yl)methanamine

Structural Information

Molecular Formula

C₈H₁₃N₃

SMILES

CN1C=CN=C1C(C2CC2)N

InChI

InChI=1S/C8H13N3/c1-11-5-4-10-8(11)7(9)6-2-3-6/h4-7H,2-3,9H2,1H3

InChIKey

UQAHJVSDSGXTPI-UHFFFAOYSA-N

Compound name

cyclopropyl-(1-methylimidazol-2-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 151.11095 Da
Monoisotopic Mass: -0.3
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]+	152.11823	134.6
[M+Na]+	174.10017	144.2
[M-H]-	150.10367	139.3
[M+NH4]+	169.14477	149.6
[M+K]+	190.07411	140.8
[M+H-H2O]+	134.10821	126.9
[M+HCOO]-	196.10915	157.5
[M+CH3COO]-	210.12480	181.8
[M+Na-2H]-	172.08562	138.6
[M]+	151.11040	135.0
[M]-	151.11150	135.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe