CID 165464036

2770359-83-4

Structural Information

Molecular Formula
C15H23NO4
SMILES
CC(C)(C)OC(=O)N1CC(C1)CC23CC(C2)(C3)C(=O)O
InChI
InChI=1S/C15H23NO4/c1-13(2,3)20-12(19)16-5-10(6-16)4-14-7-15(8-14,9-14)11(17)18/h10H,4-9H2,1-3H3,(H,17,18)
InChIKey
WCEQCQFIMWGPMF-UHFFFAOYSA-N
Compound name
3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]methyl]bicyclo[1.1.1]pentane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.16272 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.17000 193.4
[M+Na]+ 304.15194 186.7
[M+NH4]+ 299.19654 188.7
[M+K]+ 320.12588 186.0
[M-H]- 280.15544 184.9
[M+Na-2H]- 302.13739 185.9
[M]+ 281.16217 187.2
[M]- 281.16327 187.2
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.