CID 38941

N,n-dimethyl-1-(adamantan-2-yl)-2-propanamine

Structural Information

Molecular Formula
C15H27N
SMILES
CN(C)CCCC1C2CC3CC(C2)CC1C3
InChI
InChI=1S/C15H27N/c1-16(2)5-3-4-15-13-7-11-6-12(9-13)10-14(15)8-11/h11-15H,3-10H2,1-2H3
InChIKey
DGLCHIYTHOLYDF-UHFFFAOYSA-N
Compound name
3-(2-adamantyl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

221.21436 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.221636 156.3
[M+Na]+ 244.203578 156.2
[M-H]- 220.207084 152.2
[M+NH4]+ 239.248183 180.0
[M+K]+ 260.177518 153.8
[M+H-H2O]+ 204.211620 149.9
[M+HCOO]- 266.212561 164.0
[M+CH3COO]- 280.228211 164.2
[M+Na-2H]- 242.189026 163.9
[M]+ 221.21381142 156.7
[M]- 221.21490858 156.7
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.