CID 5276624

N,n,3,5-tetramethyladamantan-1-amine

Structural Information

Molecular Formula
C14H25N
SMILES
CC12CC3CC(C1)(CC(C3)(C2)N(C)C)C
InChI
InChI=1S/C14H25N/c1-12-5-11-6-13(2,8-12)10-14(7-11,9-12)15(3)4/h11H,5-10H2,1-4H3
InChIKey
KKSJGIYHSAGVMJ-UHFFFAOYSA-N
Compound name
N,N,3,5-tetramethyladamantan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

76
Patents

207.1987 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.20598 153.9
[M+Na]+ 230.18792 157.1
[M-H]- 206.19142 150.7
[M+NH4]+ 225.23252 183.7
[M+K]+ 246.16186 154.3
[M+H-H2O]+ 190.19596 146.6
[M+HCOO]- 252.19690 161.6
[M+CH3COO]- 266.21255 163.1
[M+Na-2H]- 228.17337 164.8
[M]+ 207.19815 154.7
[M]- 207.19925 154.7
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

patents stripe