CID 210793

N,n-diethyl-2-(tricyclo(3.3.1.1(sup 3,7))dec-1-yloxy)ethanamine hydrochloride

Structural Information

Molecular Formula
C16H29NO
SMILES
CCN(CC)CCOC12CC3CC(C1)CC(C3)C2
InChI
InChI=1S/C16H29NO/c1-3-17(4-2)5-6-18-16-10-13-7-14(11-16)9-15(8-13)12-16/h13-15H,3-12H2,1-2H3
InChIKey
XSALFMVTVDAVNP-UHFFFAOYSA-N
Compound name
2-(1-adamantyloxy)-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.22491 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.23219 164.2
[M+Na]+ 274.21413 163.9
[M-H]- 250.21763 159.8
[M+NH4]+ 269.25873 188.4
[M+K]+ 290.18807 161.7
[M+H-H2O]+ 234.22217 157.1
[M+HCOO]- 296.22311 171.6
[M+CH3COO]- 310.23876 171.7
[M+Na-2H]- 272.19958 172.9
[M]+ 251.22436 166.4
[M]- 251.22546 166.4
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.