CID 235340

Tetramethyl 9h-carbazole-1,2,3,4-tetracarboxylate

Structural Information

Molecular Formula
C20H17NO8
SMILES
COC(=O)C1=C2C3=CC=CC=C3NC2=C(C(=C1C(=O)OC)C(=O)OC)C(=O)OC
InChI
InChI=1S/C20H17NO8/c1-26-17(22)12-11-9-7-5-6-8-10(9)21-16(11)15(20(25)29-4)14(19(24)28-3)13(12)18(23)27-2/h5-8,21H,1-4H3
InChIKey
NNTZYLJUKVPYCE-UHFFFAOYSA-N
Compound name
tetramethyl 9H-carbazole-1,2,3,4-tetracarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

399.09543 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.10271 187.2
[M+Na]+ 422.08465 195.8
[M-H]- 398.08815 191.2
[M+NH4]+ 417.12925 200.1
[M+K]+ 438.05859 194.7
[M+H-H2O]+ 382.09269 180.3
[M+HCOO]- 444.09363 205.0
[M+CH3COO]- 458.10928 220.5
[M+Na-2H]- 420.07010 186.9
[M]+ 399.09488 197.2
[M]- 399.09598 197.2
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