CID 138991349

2309433-05-2

Structural Information

Molecular Formula
C15H25NO4
SMILES
CC(C)(C)OC(=O)N1C[C@H](C[C@H]1C(=O)O)CC2CCC2
InChI
InChI=1S/C15H25NO4/c1-15(2,3)20-14(19)16-9-11(7-10-5-4-6-10)8-12(16)13(17)18/h10-12H,4-9H2,1-3H3,(H,17,18)/t11-,12-/m0/s1
InChIKey
FSWZRPJWULLYSL-RYUDHWBXSA-N
Compound name
(2S,4S)-4-(cyclobutylmethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.17834 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.18562 171.5
[M+Na]+ 306.16756 173.2
[M+NH4]+ 301.21216 172.4
[M+K]+ 322.14150 174.1
[M-H]- 282.17106 167.3
[M+Na-2H]- 304.15301 169.1
[M]+ 283.17779 168.8
[M]- 283.17889 168.8
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.