CID 59141

101931-33-3

Structural Information

Molecular Formula
C15H16N2O2
SMILES
COC1=CC=C(C2=CC=CC=C21)CNC3=NCCO3
InChI
InChI=1S/C15H16N2O2/c1-18-14-7-6-11(10-17-15-16-8-9-19-15)12-4-2-3-5-13(12)14/h2-7H,8-10H2,1H3,(H,16,17)
InChIKey
CFXQUWTWMRFPTC-UHFFFAOYSA-N
Compound name
N-[(4-methoxynaphthalen-1-yl)methyl]-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.1212 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.128476 156.6
[M+Na]+ 279.110418 164.2
[M-H]- 255.113924 163.6
[M+NH4]+ 274.155023 173.4
[M+K]+ 295.084358 161.5
[M+H-H2O]+ 239.118460 148.5
[M+HCOO]- 301.119401 179.1
[M+CH3COO]- 315.135051 169.1
[M+Na-2H]- 277.095866 163.3
[M]+ 256.12065142 158.1
[M]- 256.12174858 158.1
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.