CID 3053872

Anc 86

Structural Information

Molecular Formula
C14H25NO4
SMILES
C1CCC(CC1)(CC(=O)OCCN2CCOCC2)O
InChI
InChI=1S/C14H25NO4/c16-13(12-14(17)4-2-1-3-5-14)19-11-8-15-6-9-18-10-7-15/h17H,1-12H2
InChIKey
VKKMHDITCWRMEG-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl 2-(1-hydroxycyclohexyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.17834 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.185616 165.9
[M+Na]+ 294.167558 166.7
[M-H]- 270.171064 168.1
[M+NH4]+ 289.212163 179.6
[M+K]+ 310.141498 166.5
[M+H-H2O]+ 254.175600 157.9
[M+HCOO]- 316.176541 177.8
[M+CH3COO]- 330.192191 191.6
[M+Na-2H]- 292.153006 168.3
[M]+ 271.17779142 160.3
[M]- 271.17888858 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.