CID 371249

Nsc645308

Structural Information

Molecular Formula
C19H15NO3
SMILES
COC1=C(C=C2C3=C(C4=C(C=CC(=C4)O)C=C3)N=CC2=C1)OC
InChI
InChI=1S/C19H15NO3/c1-22-17-7-12-10-20-19-14(15(12)9-18(17)23-2)6-4-11-3-5-13(21)8-16(11)19/h3-10,21H,1-2H3
InChIKey
KKQSZBUFOTUYNS-UHFFFAOYSA-N
Compound name
8,9-dimethoxybenzo[c]phenanthridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.1052 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.11248 169.5
[M+Na]+ 328.09442 181.1
[M-H]- 304.09792 174.2
[M+NH4]+ 323.13902 185.9
[M+K]+ 344.06836 175.5
[M+H-H2O]+ 288.10246 160.6
[M+HCOO]- 350.10340 188.7
[M+CH3COO]- 364.11905 181.5
[M+Na-2H]- 326.07987 178.4
[M]+ 305.10465 175.0
[M]- 305.10575 175.0
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.