CID 3056591

73806-56-1

Structural Information

Molecular Formula
C17H25NO3
SMILES
COC1=CC=CC(=C1)C2(CCCCC2N3CCOCC3)O
InChI
InChI=1S/C17H25NO3/c1-20-15-6-4-5-14(13-15)17(19)8-3-2-7-16(17)18-9-11-21-12-10-18/h4-6,13,16,19H,2-3,7-12H2,1H3
InChIKey
WLRVAMLHQPIKHD-UHFFFAOYSA-N
Compound name
1-(3-methoxyphenyl)-2-morpholin-4-ylcyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.18344 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.19072 170.8
[M+Na]+ 314.17266 173.5
[M-H]- 290.17616 176.8
[M+NH4]+ 309.21726 183.9
[M+K]+ 330.14660 171.6
[M+H-H2O]+ 274.18070 161.4
[M+HCOO]- 336.18164 183.6
[M+CH3COO]- 350.19729 179.7
[M+Na-2H]- 312.15811 173.4
[M]+ 291.18289 164.3
[M]- 291.18399 164.3
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.