CID 58208

2-(n-ethyl-n-(1-phenylcyclohexyl)methylamino)ethanol

Structural Information

Molecular Formula
C17H27NO
SMILES
CCN(CCO)CC1(CCCCC1)C2=CC=CC=C2
InChI
InChI=1S/C17H27NO/c1-2-18(13-14-19)15-17(11-7-4-8-12-17)16-9-5-3-6-10-16/h3,5-6,9-10,19H,2,4,7-8,11-15H2,1H3
InChIKey
UTOCBBSOPYKMNM-UHFFFAOYSA-N
Compound name
2-[ethyl-[(1-phenylcyclohexyl)methyl]amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.20926 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.216536 165.6
[M+Na]+ 284.198478 167.5
[M-H]- 260.201984 170.5
[M+NH4]+ 279.243083 183.2
[M+K]+ 300.172418 164.8
[M+H-H2O]+ 244.206520 157.8
[M+HCOO]- 306.207461 184.9
[M+CH3COO]- 320.223111 199.3
[M+Na-2H]- 282.183926 169.1
[M]+ 261.20871142 161.7
[M]- 261.20980858 161.7
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.