CID 6483032

Glycosinine

Structural Information

Molecular Formula
C14H11NO2
SMILES
COC1=CC2=C(C=C1C=O)C3=CC=CC=C3N2
InChI
InChI=1S/C14H11NO2/c1-17-14-7-13-11(6-9(14)8-16)10-4-2-3-5-12(10)15-13/h2-8,15H,1H3
InChIKey
SIUSRUNIJUFYPR-UHFFFAOYSA-N
Compound name
2-methoxy-9H-carbazole-3-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

20
Patents

225.07898 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.08626 147.1
[M+Na]+ 248.06820 158.7
[M-H]- 224.07170 151.0
[M+NH4]+ 243.11280 167.8
[M+K]+ 264.04214 153.4
[M+H-H2O]+ 208.07624 140.7
[M+HCOO]- 270.07718 169.7
[M+CH3COO]- 284.09283 160.9
[M+Na-2H]- 246.05365 154.6
[M]+ 225.07843 150.5
[M]- 225.07953 150.5
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.