CID 16211087

124656-62-8

Structural Information

Molecular Formula
C16H15N3O2
SMILES
C[C@@H](C(=O)NC1=CC2=C(C=C1)NC3=CC=CC=C3C2=O)N
InChI
InChI=1S/C16H15N3O2/c1-9(17)16(21)18-10-6-7-14-12(8-10)15(20)11-4-2-3-5-13(11)19-14/h2-9H,17H2,1H3,(H,18,21)(H,19,20)/t9-/m0/s1
InChIKey
VUXSLRUURPUHCK-VIFPVBQESA-N
Compound name
(2S)-2-amino-N-(9-oxo-10H-acridin-2-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.11642 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.12370 161.7
[M+Na]+ 304.10564 170.3
[M-H]- 280.10914 164.7
[M+NH4]+ 299.15024 177.0
[M+K]+ 320.07958 164.9
[M+H-H2O]+ 264.11368 154.0
[M+HCOO]- 326.11462 182.3
[M+CH3COO]- 340.13027 172.8
[M+Na-2H]- 302.09109 168.8
[M]+ 281.11587 160.8
[M]- 281.11697 160.8
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.