CID 216185

37154-94-2

Structural Information

Molecular Formula

C₁₅H₂₁NO

SMILES

C1CCC(CC1)N2CC(OC2)C3=CC=CC=C3

InChI

InChI=1S/C15H21NO/c1-3-7-13(8-4-1)15-11-16(12-17-15)14-9-5-2-6-10-14/h1,3-4,7-8,14-15H,2,5-6,9-12H2

InChIKey

NOOCIQOCOHHDBS-UHFFFAOYSA-N

Compound name

3-cyclohexyl-5-phenyl-1,3-oxazolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 231.16231 Da
Monoisotopic Mass: 3.3
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]+	232.169586	154.3
[M+Na]+	254.151528	157.5
[M-H]-	230.155034	161.7
[M+NH4]+	249.196133	170.3
[M+K]+	270.125468	155.3
[M+H-H2O]+	214.159570	145.7
[M+HCOO]-	276.160511	171.3
[M+CH3COO]-	290.176161	165.1
[M+Na-2H]-	252.136976	156.2
[M]+	231.16176142	147.5
[M]-	231.16285858	147.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.