CID 336383

78439-81-3

Structural Information

Molecular Formula
C21H14N2O4
SMILES
COC1=C2C(=C(C3=C1OC=C3)N=CC4=CNC5=CC=CC=C54)C=CC(=O)O2
InChI
InChI=1S/C21H14N2O4/c1-25-21-19-15(8-9-26-19)18(14-6-7-17(24)27-20(14)21)23-11-12-10-22-16-5-3-2-4-13(12)16/h2-11,22H,1H3
InChIKey
UIBXYGGVAZPCJO-UHFFFAOYSA-N
Compound name
4-(1H-indol-3-ylmethylideneamino)-9-methoxyfuro[3,2-g]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.09537 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.10265 179.9
[M+Na]+ 381.08459 193.2
[M-H]- 357.08809 191.7
[M+NH4]+ 376.12919 195.4
[M+K]+ 397.05853 189.3
[M+H-H2O]+ 341.09263 172.7
[M+HCOO]- 403.09357 204.1
[M+CH3COO]- 417.10922 193.4
[M+Na-2H]- 379.07004 186.7
[M]+ 358.09482 189.3
[M]- 358.09592 189.3
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.