CID 3010141

2-(1-adamantyl)-n-methyl-propan-2-amine

Structural Information

Molecular Formula
C14H25N
SMILES
CC(C)(C12CC3CC(C1)CC(C3)C2)NC
InChI
InChI=1S/C14H25N/c1-13(2,15-3)14-7-10-4-11(8-14)6-12(5-10)9-14/h10-12,15H,4-9H2,1-3H3
InChIKey
NSHWKGKBHZMAFK-UHFFFAOYSA-N
Compound name
2-(1-adamantyl)-N-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

207.1987 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.20598 155.3
[M+Na]+ 230.18792 156.5
[M-H]- 206.19142 150.3
[M+NH4]+ 225.23252 180.9
[M+K]+ 246.16186 153.3
[M+H-H2O]+ 190.19596 149.7
[M+HCOO]- 252.19690 161.3
[M+CH3COO]- 266.21255 163.4
[M+Na-2H]- 228.17337 166.4
[M]+ 207.19815 154.1
[M]- 207.19925 154.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.