CID 40746

1-methyl-2-phenylimidazolidine

Structural Information

Molecular Formula

C₁₀H₁₄N₂

SMILES

CN1CCNC1C2=CC=CC=C2

InChI

InChI=1S/C10H14N2/c1-12-8-7-11-10(12)9-5-3-2-4-6-9/h2-6,10-11H,7-8H2,1H3

InChIKey

HOPXNJUXPFWPED-UHFFFAOYSA-N

Compound name

1-methyl-2-phenylimidazolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 162.11569 Da
Monoisotopic Mass: 1.2
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]+	163.122966	135.7
[M+Na]+	185.104908	142.5
[M-H]-	161.108414	138.0
[M+NH4]+	180.149513	154.7
[M+K]+	201.078848	139.2
[M+H-H2O]+	145.112950	128.0
[M+HCOO]-	207.113891	155.3
[M+CH3COO]-	221.129541	148.1
[M+Na-2H]-	183.090356	140.1
[M]+	162.11514142	130.9
[M]-	162.11623858	130.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe