CID 3064887

105973-46-4

Structural Information

Molecular Formula

C₁₂H₁₇NO

SMILES

CC1(N(CC(O1)C2=CC=CC=C2)C)C

InChI

InChI=1S/C12H17NO/c1-12(2)13(3)9-11(14-12)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3

InChIKey

ZFKUGYGJZATGRG-UHFFFAOYSA-N

Compound name

2,2,3-trimethyl-5-phenyl-1,3-oxazolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 128
Patents: 191.13101 Da
Monoisotopic Mass: 2.1
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]+	192.13829	142.4
[M+Na]+	214.12023	155.6
[M+NH4]+	209.16483	153.0
[M+K]+	230.09417	148.8
[M-H]-	190.12373	147.4
[M+Na-2H]-	212.10568	150.7
[M]+	191.13046	145.9
[M]-	191.13156	145.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe