CID 364379

Nsc630438

Structural Information

Molecular Formula
C23H20O4
SMILES
CC1=C2CCC3(C2=CC=C1)C4=C(C5=C(C=CC(=C5C=C4)OC)OC)C(=O)O3
InChI
InChI=1S/C23H20O4/c1-13-5-4-6-16-14(13)11-12-23(16)17-8-7-15-18(25-2)9-10-19(26-3)20(15)21(17)22(24)27-23/h4-10H,11-12H2,1-3H3
InChIKey
IKMGJOYMJFXAJF-UHFFFAOYSA-N
Compound name
6',9'-dimethoxy-7-methylspiro[1,2-dihydroindene-3,3'-benzo[g][2]benzofuran]-1'-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.13617 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.14345 185.2
[M+Na]+ 383.12539 196.7
[M-H]- 359.12889 195.6
[M+NH4]+ 378.16999 206.1
[M+K]+ 399.09933 192.0
[M+H-H2O]+ 343.13343 178.9
[M+HCOO]- 405.13437 204.0
[M+CH3COO]- 419.15002 197.7
[M+Na-2H]- 381.11084 187.4
[M]+ 360.13562 191.1
[M]- 360.13672 191.1
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.