CID 3010142

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

Structural Information

Molecular Formula
C15H27N
SMILES
CCNC(C)(C)C12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C15H27N/c1-4-16-14(2,3)15-8-11-5-12(9-15)7-13(6-11)10-15/h11-13,16H,4-10H2,1-3H3
InChIKey
WDOCZNQOCMJHJZ-UHFFFAOYSA-N
Compound name
2-(1-adamantyl)-N-ethylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

221.21436 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.221636 159.8
[M+Na]+ 244.203578 160.6
[M-H]- 220.207084 154.6
[M+NH4]+ 239.248183 184.9
[M+K]+ 260.177518 157.2
[M+H-H2O]+ 204.211620 154.0
[M+HCOO]- 266.212561 165.5
[M+CH3COO]- 280.228211 167.5
[M+Na-2H]- 242.189026 170.4
[M]+ 221.21381142 158.9
[M]- 221.21490858 158.9
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.