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]+ 306.112476 169.5
[M+Na]+ 328.094418 181.1
[M-H]- 304.097924 174.2
[M+NH4]+ 323.139023 185.9
[M+K]+ 344.068358 175.5
[M+H-H2O]+ 288.102460 160.6
[M+HCOO]- 350.103401 188.7
[M+CH3COO]- 364.119051 181.5
[M+Na-2H]- 326.079866 178.4
[M]+ 305.10465142 175.0
[M]- 305.10574858 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.