CID 69762135

1822461-82-4

Structural Information

Molecular Formula
C14H26N2O4
SMILES
CC(C)(C)OC(=O)NC(CC1CCNCC1)C(=O)OC
InChI
InChI=1S/C14H26N2O4/c1-14(2,3)20-13(18)16-11(12(17)19-4)9-10-5-7-15-8-6-10/h10-11,15H,5-9H2,1-4H3,(H,16,18)
InChIKey
XDDGBQROWLQELC-UHFFFAOYSA-N
Compound name
methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-piperidin-4-ylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

286.18927 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.19655 170.0
[M+Na]+ 309.17849 171.2
[M-H]- 285.18199 169.2
[M+NH4]+ 304.22309 182.9
[M+K]+ 325.15243 170.8
[M+H-H2O]+ 269.18653 163.0
[M+HCOO]- 331.18747 183.5
[M+CH3COO]- 345.20312 199.4
[M+Na-2H]- 307.16394 170.0
[M]+ 286.18872 167.0
[M]- 286.18982 167.0
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

patents stripe