CID 11322692

Chembl5274869

Structural Information

Molecular Formula
C15H9NO3
SMILES
C1=CC2=C(C=C1O)NC3=C2C=C(C4=C3C=CO4)C=O
InChI
InChI=1S/C15H9NO3/c17-7-8-5-12-10-2-1-9(18)6-13(10)16-14(12)11-3-4-19-15(8)11/h1-7,16,18H
InChIKey
YBJULDBBRCYNQP-UHFFFAOYSA-N
Compound name
8-hydroxy-10H-furo[3,2-a]carbazole-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

251.05824 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.06552 150.9
[M+Na]+ 274.04746 164.7
[M-H]- 250.05096 156.5
[M+NH4]+ 269.09206 171.6
[M+K]+ 290.02140 159.6
[M+H-H2O]+ 234.05550 146.1
[M+HCOO]- 296.05644 172.9
[M+CH3COO]- 310.07209 165.3
[M+Na-2H]- 272.03291 158.3
[M]+ 251.05769 156.6
[M]- 251.05879 156.6
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

patents stripe