CID 380314

101607-44-7

Structural Information

Molecular Formula
C20H26FN3O3
SMILES
CN(C)N1C(=O)CC2(C1=O)CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F
InChI
InChI=1S/C20H26FN3O3/c1-22(2)24-18(26)14-20(19(24)27)9-12-23(13-10-20)11-3-4-17(25)15-5-7-16(21)8-6-15/h5-8H,3-4,9-14H2,1-2H3
InChIKey
ILVXNXRHHAUIEM-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-8-[4-(4-fluorophenyl)-4-oxobutyl]-2,8-diazaspiro[4.5]decane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.19583 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.20311 191.1
[M+Na]+ 398.18505 199.3
[M+NH4]+ 393.22965 197.3
[M+K]+ 414.15899 193.8
[M-H]- 374.18855 192.3
[M+Na-2H]- 396.17050 195.2
[M]+ 375.19528 192.2
[M]- 375.19638 192.2
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.