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]+ 382.164896 191.1
[M+Na]+ 404.146838 203.8
[M-H]- 380.150344 197.8
[M+NH4]+ 399.191443 207.8
[M+K]+ 420.120778 199.8
[M+H-H2O]+ 364.154880 183.3
[M+HCOO]- 426.155821 210.3
[M+CH3COO]- 440.171471 226.4
[M+Na-2H]- 402.132286 192.5
[M]+ 381.15707142 202.6
[M]- 381.15816858 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.