CID 135397344

4-methoxy-4-oxo-2-(piperidin-1-yl)butanoic acid hydrochloride

Structural Information

Molecular Formula
C10H17NO4
SMILES
COC(=O)CC(C(=O)O)N1CCCCC1
InChI
InChI=1S/C10H17NO4/c1-15-9(12)7-8(10(13)14)11-5-3-2-4-6-11/h8H,2-7H2,1H3,(H,13,14)
InChIKey
OKDRCPVZRUMGNI-UHFFFAOYSA-N
Compound name
4-methoxy-4-oxo-2-piperidin-1-ylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.11575 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 148.7
[M+Na]+ 238.10497 151.9
[M-H]- 214.10847 148.3
[M+NH4]+ 233.14957 164.5
[M+K]+ 254.07891 151.8
[M+H-H2O]+ 198.11301 142.0
[M+HCOO]- 260.11395 164.1
[M+CH3COO]- 274.12960 183.9
[M+Na-2H]- 236.09042 149.4
[M]+ 215.11520 145.8
[M]- 215.11630 145.8
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.