CID 58171

101077-08-1

Structural Information

Molecular Formula
C12H14N2O
SMILES
C1COC(=N1)NC2CC2C3=CC=CC=C3
InChI
InChI=1S/C12H14N2O/c1-2-4-9(5-3-1)10-8-11(10)14-12-13-6-7-15-12/h1-5,10-11H,6-8H2,(H,13,14)
InChIKey
OXLVPXCJOFNLRS-UHFFFAOYSA-N
Compound name
N-(2-phenylcyclopropyl)-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.11061 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.117886 141.6
[M+Na]+ 225.099828 150.3
[M-H]- 201.103334 151.3
[M+NH4]+ 220.144433 154.7
[M+K]+ 241.073768 147.8
[M+H-H2O]+ 185.107870 133.8
[M+HCOO]- 247.108811 165.5
[M+CH3COO]- 261.124461 154.7
[M+Na-2H]- 223.085276 148.2
[M]+ 202.11006142 142.7
[M]- 202.11115858 142.7
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.