CID 416925

9h-carbazole-3-sulfonic acid

Structural Information

Molecular Formula
C12H9NO3S
SMILES
C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)S(=O)(=O)O
InChI
InChI=1S/C12H9NO3S/c14-17(15,16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)13-12/h1-7,13H,(H,14,15,16)
InChIKey
YZBZIFVZGHFVBS-UHFFFAOYSA-N
Compound name
9H-carbazole-3-sulfonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

247.03032 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.037596 150.8
[M+Na]+ 270.019538 162.8
[M-H]- 246.023044 153.7
[M+NH4]+ 265.064143 170.4
[M+K]+ 285.993478 157.2
[M+H-H2O]+ 230.027580 146.2
[M+HCOO]- 292.028521 166.5
[M+CH3COO]- 306.044171 163.8
[M+Na-2H]- 268.004986 158.1
[M]+ 247.02977142 154.4
[M]- 247.03086858 154.4
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