CID 59160

Acridine, 9-(2-oxazolin-2-ylamino)-

Structural Information

Molecular Formula
C16H13N3O
SMILES
C1COC(=N1)NC2=C3C=CC=CC3=NC4=CC=CC=C42
InChI
InChI=1S/C16H13N3O/c1-3-7-13-11(5-1)15(19-16-17-9-10-20-16)12-6-2-4-8-14(12)18-13/h1-8H,9-10H2,(H,17,18,19)
InChIKey
UHIUPIUDPQWQEY-UHFFFAOYSA-N
Compound name
N-acridin-9-yl-4,5-dihydro-1,3-oxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.10587 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.11315 156.0
[M+Na]+ 286.09509 165.8
[M-H]- 262.09859 163.0
[M+NH4]+ 281.13969 172.1
[M+K]+ 302.06903 161.1
[M+H-H2O]+ 246.10313 146.9
[M+HCOO]- 308.10407 177.7
[M+CH3COO]- 322.11972 168.6
[M+Na-2H]- 284.08054 165.8
[M]+ 263.10532 157.2
[M]- 263.10642 157.2
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.