CID 379224

2-diphenylmethylamino-2-oxazoline

Structural Information

Molecular Formula
C16H16N2O
SMILES
C1COC(=N1)NC(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C16H16N2O/c1-3-7-13(8-4-1)15(14-9-5-2-6-10-14)18-16-17-11-12-19-16/h1-10,15H,11-12H2,(H,17,18)
InChIKey
PKQVSBQIQNUSJC-UHFFFAOYSA-N
Compound name
N-benzhydryl-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.12627 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.13355 156.8
[M+Na]+ 275.11549 161.7
[M-H]- 251.11899 165.2
[M+NH4]+ 270.16009 171.6
[M+K]+ 291.08943 158.8
[M+H-H2O]+ 235.12353 147.7
[M+HCOO]- 297.12447 179.2
[M+CH3COO]- 311.14012 168.4
[M+Na-2H]- 273.10094 162.5
[M]+ 252.12572 154.4
[M]- 252.12682 154.4
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

No patent data available for this compound.