CID 3077980

Brn 3570707

Structural Information

Molecular Formula
C22H23NO5
SMILES
CC1C2=CC(=C(C=C2C3=C1C4=CC(=C(C=C4C(=O)N3C)OC)OC)OC)OC
InChI
InChI=1S/C22H23NO5/c1-11-12-7-16(25-3)18(27-5)9-14(12)21-20(11)13-8-17(26-4)19(28-6)10-15(13)22(24)23(21)2/h7-11H,1-6H3
InChIKey
MOUPCSKJANDCNB-UHFFFAOYSA-N
Compound name
2,3,8,9-tetramethoxy-6,11-dimethyl-11H-indeno[1,2-c]isoquinolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.15762 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.16490 191.1
[M+Na]+ 404.14684 203.8
[M-H]- 380.15034 197.8
[M+NH4]+ 399.19144 207.8
[M+K]+ 420.12078 199.8
[M+H-H2O]+ 364.15488 183.3
[M+HCOO]- 426.15582 210.3
[M+CH3COO]- 440.17147 226.4
[M+Na-2H]- 402.13229 192.5
[M]+ 381.15707 202.6
[M]- 381.15817 202.6
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.