CID 56829888

4-(2-(2-(2-methoxyethoxy)ethoxy)ethyl)piperidine

Structural Information

Molecular Formula
C12H25NO3
SMILES
COCCOCCOCCC1CCNCC1
InChI
InChI=1S/C12H25NO3/c1-14-8-9-16-11-10-15-7-4-12-2-5-13-6-3-12/h12-13H,2-11H2,1H3
InChIKey
ANKCOHZEHZJMHB-UHFFFAOYSA-N
Compound name
4-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

231.18344 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.19072 157.0
[M+Na]+ 254.17266 159.3
[M-H]- 230.17616 155.7
[M+NH4]+ 249.21726 172.4
[M+K]+ 270.14660 157.9
[M+H-H2O]+ 214.18070 149.3
[M+HCOO]- 276.18164 173.9
[M+CH3COO]- 290.19729 187.5
[M+Na-2H]- 252.15811 160.0
[M]+ 231.18289 156.6
[M]- 231.18399 156.6
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

patents stripe