CID 71307677

1807941-28-1

Structural Information

Molecular Formula
C8H15NO2
SMILES
CCOC(=O)[C@@H]1CC[C@@H](C1)N
InChI
InChI=1S/C8H15NO2/c1-2-11-8(10)6-3-4-7(9)5-6/h6-7H,2-5,9H2,1H3/t6-,7+/m1/s1
InChIKey
GBSHHLOUZFKHSC-RQJHMYQMSA-N
Compound name
ethyl (1R,3S)-3-aminocyclopentane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

157.11028 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 135.4
[M+Na]+ 180.09950 141.1
[M-H]- 156.10300 138.1
[M+NH4]+ 175.14410 157.5
[M+K]+ 196.07344 140.5
[M+H-H2O]+ 140.10754 130.0
[M+HCOO]- 202.10848 158.1
[M+CH3COO]- 216.12413 177.7
[M+Na-2H]- 178.08495 137.2
[M]+ 157.10973 132.7
[M]- 157.11083 132.7
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

patents stripe