CID 129369630

2166040-50-0

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1CC1[C@@H]2CNC[C@H]2C(=O)O
InChI
InChI=1S/C8H13NO2/c10-8(11)7-4-9-3-6(7)5-1-2-5/h5-7,9H,1-4H2,(H,10,11)/t6-,7+/m0/s1
InChIKey
FVSSNRDCBCSLGC-NKWVEPMBSA-N
Compound name
(3S,4S)-4-cyclopropylpyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 133.3
[M+Na]+ 178.083858 141.1
[M-H]- 154.087364 136.6
[M+NH4]+ 173.128463 148.3
[M+K]+ 194.057798 137.4
[M+H-H2O]+ 138.091900 127.2
[M+HCOO]- 200.092841 151.7
[M+CH3COO]- 214.108491 174.0
[M+Na-2H]- 176.069306 135.4
[M]+ 155.09409142 130.7
[M]- 155.09518858 130.7
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.