CID 166449

Carbazomycin b

Structural Information

Molecular Formula
C15H15NO2
SMILES
CC1=C(C(=C(C2=C1NC3=CC=CC=C32)O)OC)C
InChI
InChI=1S/C15H15NO2/c1-8-9(2)15(18-3)14(17)12-10-6-4-5-7-11(10)16-13(8)12/h4-7,16-17H,1-3H3
InChIKey
OBMFXFPFPDTBHG-UHFFFAOYSA-N
Compound name
3-methoxy-1,2-dimethyl-9H-carbazol-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

12
References

30
Patents

241.11028 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11756 153.3
[M+Na]+ 264.09950 168.6
[M+NH4]+ 259.14410 162.3
[M+K]+ 280.07344 163.0
[M-H]- 240.10300 155.7
[M+Na-2H]- 262.08495 158.7
[M]+ 241.10973 156.3
[M]- 241.11083 156.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe