CID 2060977

2-(adamantan-1-yloxy)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C12H21NO
SMILES
C1C2CC3CC1CC(C2)(C3)OCCN
InChI
InChI=1S/C12H21NO/c13-1-2-14-12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11H,1-8,13H2
InChIKey
SSMRLTOOLLVHLW-UHFFFAOYSA-N
Compound name
2-(1-adamantyloxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

195.16231 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.169586 145.9
[M+Na]+ 218.151528 147.6
[M-H]- 194.155034 140.7
[M+NH4]+ 213.196133 171.6
[M+K]+ 234.125468 144.7
[M+H-H2O]+ 178.159570 139.9
[M+HCOO]- 240.160511 153.9
[M+CH3COO]- 254.176161 154.6
[M+Na-2H]- 216.136976 156.8
[M]+ 195.16176142 145.1
[M]- 195.16285858 145.1
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.