CID 7131816

875156-97-1

Structural Information

Molecular Formula
C10H17ClN2O3
SMILES
CCOC(=O)N1CCC(CC1)NC(=O)CCl
InChI
InChI=1S/C10H17ClN2O3/c1-2-16-10(15)13-5-3-8(4-6-13)12-9(14)7-11/h8H,2-7H2,1H3,(H,12,14)
InChIKey
QHXPNDBRFVFWIV-UHFFFAOYSA-N
Compound name
ethyl 4-[(2-chloroacetyl)amino]piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.09277 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.10005 154.9
[M+Na]+ 271.08199 159.8
[M-H]- 247.08549 156.1
[M+NH4]+ 266.12659 171.3
[M+K]+ 287.05593 157.6
[M+H-H2O]+ 231.09003 148.7
[M+HCOO]- 293.09097 169.2
[M+CH3COO]- 307.10662 192.0
[M+Na-2H]- 269.06744 156.5
[M]+ 248.09222 154.5
[M]- 248.09332 154.5
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.