CID 319003

5-methyl-3-phenyl-1,3-oxazolidine

Structural Information

Molecular Formula
C10H13NO
SMILES
CC1CN(CO1)C2=CC=CC=C2
InChI
InChI=1S/C10H13NO/c1-9-7-11(8-12-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChIKey
VJPMKAHLPYDCHH-UHFFFAOYSA-N
Compound name
5-methyl-3-phenyl-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

163.09972 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.106996 133.5
[M+Na]+ 186.088938 140.8
[M-H]- 162.092444 139.3
[M+NH4]+ 181.133543 153.2
[M+K]+ 202.062878 139.9
[M+H-H2O]+ 146.096980 126.7
[M+HCOO]- 208.097921 155.2
[M+CH3COO]- 222.113571 147.3
[M+Na-2H]- 184.074386 139.3
[M]+ 163.09917142 132.0
[M]- 163.10026858 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe