CID 3053850

Anc 148

Structural Information

Molecular Formula
C12H23NO3
SMILES
CN(C)CCOC(=O)COC1CCCCC1
InChI
InChI=1S/C12H23NO3/c1-13(2)8-9-15-12(14)10-16-11-6-4-3-5-7-11/h11H,3-10H2,1-2H3
InChIKey
ZFSQNMDPGDNXOY-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl 2-cyclohexyloxyacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.1678 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.17508 155.0
[M+Na]+ 252.15702 162.7
[M+NH4]+ 247.20162 162.1
[M+K]+ 268.13096 157.7
[M-H]- 228.16052 156.2
[M+Na-2H]- 250.14247 158.3
[M]+ 229.16725 156.0
[M]- 229.16835 156.0
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.