CID 3038716

Morpholine, 4-(2-(1-phenylcyclohexyl)ethyl)-, hydrochloride

Structural Information

Molecular Formula
C18H27NO
SMILES
C1CCC(CC1)(CCN2CCOCC2)C3=CC=CC=C3
InChI
InChI=1S/C18H27NO/c1-3-7-17(8-4-1)18(9-5-2-6-10-18)11-12-19-13-15-20-16-14-19/h1,3-4,7-8H,2,5-6,9-16H2
InChIKey
OIPIWXZEOQPBFP-UHFFFAOYSA-N
Compound name
4-[2-(1-phenylcyclohexyl)ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.20926 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.21654 168.6
[M+Na]+ 296.19848 169.6
[M-H]- 272.20198 174.9
[M+NH4]+ 291.24308 182.5
[M+K]+ 312.17242 167.0
[M+H-H2O]+ 256.20652 158.4
[M+HCOO]- 318.20746 182.2
[M+CH3COO]- 332.22311 177.2
[M+Na-2H]- 294.18393 172.2
[M]+ 273.20871 160.3
[M]- 273.20981 160.3
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.