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]+ 251.211786 160.6
[M+Na]+ 273.193728 160.0
[M-H]- 249.197234 156.1
[M+NH4]+ 268.238333 184.3
[M+K]+ 289.167668 158.2
[M+H-H2O]+ 233.201770 154.0
[M+HCOO]- 295.202711 168.5
[M+CH3COO]- 309.218361 168.0
[M+Na-2H]- 271.179176 169.5
[M]+ 250.20396142 160.5
[M]- 250.20505858 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.