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]+ 222.22164 159.8
[M+Na]+ 244.20358 160.6
[M-H]- 220.20708 154.6
[M+NH4]+ 239.24818 184.9
[M+K]+ 260.17752 157.2
[M+H-H2O]+ 204.21162 154.0
[M+HCOO]- 266.21256 165.5
[M+CH3COO]- 280.22821 167.5
[M+Na-2H]- 242.18903 170.4
[M]+ 221.21381 158.9
[M]- 221.21491 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.