CID 64242

Brn 2847573

Structural Information

Molecular Formula
C15H26N2O
SMILES
CN(C)CCC(=O)NC12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C15H26N2O/c1-17(2)4-3-14(18)16-15-8-11-5-12(9-15)7-13(6-11)10-15/h11-13H,3-10H2,1-2H3,(H,16,18)
InChIKey
JNIOKNPUIGUBAT-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)-3-(dimethylamino)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.20451 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.21179 160.6
[M+Na]+ 273.19373 160.0
[M-H]- 249.19723 156.1
[M+NH4]+ 268.23833 184.3
[M+K]+ 289.16767 158.2
[M+H-H2O]+ 233.20177 154.0
[M+HCOO]- 295.20271 168.5
[M+CH3COO]- 309.21836 168.0
[M+Na-2H]- 271.17918 169.5
[M]+ 250.20396 160.5
[M]- 250.20506 160.5
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.