CID 394680

Nsc698283

Structural Information

Molecular Formula
C23H22N2O6
SMILES
COC1=CC=C(C=C1)C2CC(=O)CC(C23C(=O)NC(=O)NC3=O)C4=CC=C(C=C4)OC
InChI
InChI=1S/C23H22N2O6/c1-30-16-7-3-13(4-8-16)18-11-15(26)12-19(14-5-9-17(31-2)10-6-14)23(18)20(27)24-22(29)25-21(23)28/h3-10,18-19H,11-12H2,1-2H3,(H2,24,25,27,28,29)
InChIKey
PEUKXDMLRFLUFJ-UHFFFAOYSA-N
Compound name
7,11-bis(4-methoxyphenyl)-2,4-diazaspiro[5.5]undecane-1,3,5,9-tetrone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

422.1478 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.15508 200.9
[M+Na]+ 445.13702 207.2
[M-H]- 421.14052 207.0
[M+NH4]+ 440.18162 208.3
[M+K]+ 461.11096 201.6
[M+H-H2O]+ 405.14506 189.6
[M+HCOO]- 467.14600 211.8
[M+CH3COO]- 481.16165 222.9
[M+Na-2H]- 443.12247 199.5
[M]+ 422.14725 196.2
[M]- 422.14835 196.2
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

No patent data available for this compound.