CID 363004

Nsc627543

Structural Information

Molecular Formula
C16H9NO3
SMILES
CC1=CC2=C(C3=NOC=C13)C(=O)C4=CC=CC=C4C2=O
InChI
InChI=1S/C16H9NO3/c1-8-6-11-13(14-12(8)7-20-17-14)16(19)10-5-3-2-4-9(10)15(11)18/h2-7H,1H3
InChIKey
CSLKMYOHINILJD-UHFFFAOYSA-N
Compound name
4-methylnaphtho[2,3-g][2,1]benzoxazole-6,11-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.05826 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.06554 154.8
[M+Na]+ 286.04748 168.3
[M-H]- 262.05098 162.1
[M+NH4]+ 281.09208 174.4
[M+K]+ 302.02142 164.0
[M+H-H2O]+ 246.05552 147.9
[M+HCOO]- 308.05646 175.8
[M+CH3COO]- 322.07211 169.1
[M+Na-2H]- 284.03293 162.5
[M]+ 263.05771 160.1
[M]- 263.05881 160.1
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.