CID 3066834

Triethylamine, 2-((1-phenylcyclohexyl)oxy)-, hydrochloride

Structural Information

Molecular Formula
C18H29NO
SMILES
CCN(CC)CCOC1(CCCCC1)C2=CC=CC=C2
InChI
InChI=1S/C18H29NO/c1-3-19(4-2)15-16-20-18(13-9-6-10-14-18)17-11-7-5-8-12-17/h5,7-8,11-12H,3-4,6,9-10,13-16H2,1-2H3
InChIKey
WKJUBQRWYGAUNH-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(1-phenylcyclohexyl)oxyethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.2249 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.23218 169.8
[M+Na]+ 298.21412 171.7
[M-H]- 274.21762 175.9
[M+NH4]+ 293.25872 187.6
[M+K]+ 314.18806 169.7
[M+H-H2O]+ 258.22216 161.5
[M+HCOO]- 320.22310 190.3
[M+CH3COO]- 334.23875 204.9
[M+Na-2H]- 296.19957 173.2
[M]+ 275.22435 168.2
[M]- 275.22545 168.2
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.