CID 11299565

287401-41-6

Structural Information

Molecular Formula
C11H19NO5
SMILES
CC(C)(C)OC(=O)N1CCC[C@@]1(CO)C(=O)O
InChI
InChI=1S/C11H19NO5/c1-10(2,3)17-9(16)12-6-4-5-11(12,7-13)8(14)15/h13H,4-7H2,1-3H3,(H,14,15)/t11-/m1/s1
InChIKey
RYSMMYRGSNWYHF-LLVKDONJSA-N
Compound name
(2R)-2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

245.12633 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.13361 155.2
[M+Na]+ 268.11555 160.9
[M-H]- 244.11905 154.6
[M+NH4]+ 263.16015 173.7
[M+K]+ 284.08949 160.6
[M+H-H2O]+ 228.12359 151.2
[M+HCOO]- 290.12453 170.6
[M+CH3COO]- 304.14018 185.0
[M+Na-2H]- 266.10100 157.0
[M]+ 245.12578 155.1
[M]- 245.12688 155.1
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