CID 3068526

83521-93-1

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

CN1CCN(C1C2=CC=C(C=C2)O)C

InChI

InChI=1S/C11H16N2O/c1-12-7-8-13(2)11(12)9-3-5-10(14)6-4-9/h3-6,11,14H,7-8H2,1-2H3

InChIKey

UNGVPPUVXDSRGH-UHFFFAOYSA-N

Compound name

4-(1,3-dimethylimidazolidin-2-yl)phenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 192.12627 Da
Monoisotopic Mass: 1.3
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]+	193.13355	143.3
[M+Na]+	215.11549	151.5
[M-H]-	191.11899	146.3
[M+NH4]+	210.16009	161.7
[M+K]+	231.08943	148.3
[M+H-H2O]+	175.12353	135.9
[M+HCOO]-	237.12447	162.7
[M+CH3COO]-	251.14012	181.8
[M+Na-2H]-	213.10094	145.7
[M]+	192.12572	141.0
[M]-	192.12682	141.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe