CID 5465762

Nsc660812

Structural Information

Molecular Formula
C20H19NO3
SMILES
CC1=C2C(=CC=C1)N(C3=C(C2=O)C(=CC4=C3C=CC(O4)(C)C)O)C
InChI
InChI=1S/C20H19NO3/c1-11-6-5-7-13-16(11)19(23)17-14(22)10-15-12(18(17)21(13)4)8-9-20(2,3)24-15/h5-10,22H,1-4H3
InChIKey
CSYSIDMKPSHLMD-UHFFFAOYSA-N
Compound name
6-hydroxy-3,3,8,12-tetramethylpyrano[2,3-c]acridin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.1365 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.14378 175.5
[M+Na]+ 344.12572 189.2
[M-H]- 320.12922 181.6
[M+NH4]+ 339.17032 192.7
[M+K]+ 360.09966 184.4
[M+H-H2O]+ 304.13376 166.8
[M+HCOO]- 366.13470 192.1
[M+CH3COO]- 380.15035 187.9
[M+Na-2H]- 342.11117 183.0
[M]+ 321.13595 181.2
[M]- 321.13705 181.2
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.