CID 3066857

Brn 0031172

Structural Information

Molecular Formula

C₁₄H₁₆N₂O₃

SMILES

C1CC2(CC3=CC=CC=C31)C(=O)N(C(=O)N2)CCO

InChI

InChI=1S/C14H16N2O3/c17-8-7-16-12(18)14(15-13(16)19)6-5-10-3-1-2-4-11(10)9-14/h1-4,17H,5-9H2,(H,15,19)

InChIKey

PFMXLIVXAIVNPK-UHFFFAOYSA-N

Compound name

3'-(2-hydroxyethyl)spiro[2,4-dihydro-1H-naphthalene-3,5'-imidazolidine]-2',4'-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 260.1161 Da
Monoisotopic Mass: 0.7
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]+	261.123376	159.7
[M+Na]+	283.105318	167.5
[M-H]-	259.108824	160.7
[M+NH4]+	278.149923	177.5
[M+K]+	299.079258	162.2
[M+H-H2O]+	243.113360	152.5
[M+HCOO]-	305.114301	174.1
[M+CH3COO]-	319.129951	170.0
[M+Na-2H]-	281.090766	162.8
[M]+	260.11555142	155.1
[M]-	260.11664858	155.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.