CID 145913440

2377030-48-1

Structural Information

Molecular Formula
C15H23NO4
SMILES
CC(C)(C)OC(=O)N1CC(C[C@H]1C(=O)O)C23CC(C2)C3
InChI
InChI=1S/C15H23NO4/c1-14(2,3)20-13(19)16-8-10(4-11(16)12(17)18)15-5-9(6-15)7-15/h9-11H,4-8H2,1-3H3,(H,17,18)/t9?,10?,11-,15?/m0/s1
InChIKey
AWOFXTCXNQQBTB-RUIJOYPPSA-N
Compound name
(2S)-4-(1-bicyclo[1.1.1]pentanyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

281.16272 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.17000 179.5
[M+Na]+ 304.15194 173.8
[M+NH4]+ 299.19654 176.0
[M+K]+ 320.12588 175.4
[M-H]- 280.15544 170.6
[M+Na-2H]- 302.13739 171.5
[M]+ 281.16217 173.2
[M]- 281.16327 173.2
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

patents stripe