CID 375142

Mukoeic acid

Structural Information

Molecular Formula
C14H11NO3
SMILES
COC1=CC(=CC2=C1NC3=CC=CC=C32)C(=O)O
InChI
InChI=1S/C14H11NO3/c1-18-12-7-8(14(16)17)6-10-9-4-2-3-5-11(9)15-13(10)12/h2-7,15H,1H3,(H,16,17)
InChIKey
VZOALRHIINZPKX-UHFFFAOYSA-N
Compound name
1-methoxy-9H-carbazole-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

8
Patents

241.0739 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.08118 150.7
[M+Na]+ 264.06312 161.3
[M-H]- 240.06662 153.3
[M+NH4]+ 259.10772 169.8
[M+K]+ 280.03706 156.4
[M+H-H2O]+ 224.07116 144.6
[M+HCOO]- 286.07210 170.9
[M+CH3COO]- 300.08775 163.5
[M+Na-2H]- 262.04857 156.7
[M]+ 241.07335 153.1
[M]- 241.07445 153.1
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.