CID 64531

Benzeneacetamide, n-(4,8,8-trimethyl-1-azatricyclo(3.3.1.1(sup 3,7))dec-4-yl)-

Structural Information

Molecular Formula
C20H28N2O
SMILES
CC1(C2CC3CN1CC(C2)C3(C)NC(=O)CC4=CC=CC=C4)C
InChI
InChI=1S/C20H28N2O/c1-19(2)15-10-16-12-22(19)13-17(11-15)20(16,3)21-18(23)9-14-7-5-4-6-8-14/h4-8,15-17H,9-13H2,1-3H3,(H,21,23)
InChIKey
DUOANANYKYXIQY-UHFFFAOYSA-N
Compound name
2-phenyl-N-(4,8,8-trimethyl-1-azatricyclo[3.3.1.13,7]decan-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

312.22015 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.22743 177.1
[M+Na]+ 335.20937 179.3
[M-H]- 311.21287 173.8
[M+NH4]+ 330.25397 198.9
[M+K]+ 351.18331 174.5
[M+H-H2O]+ 295.21741 167.2
[M+HCOO]- 357.21835 182.0
[M+CH3COO]- 371.23400 183.7
[M+Na-2H]- 333.19482 185.4
[M]+ 312.21960 177.3
[M]- 312.22070 177.3
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

patents stripe