CID 11116030

(s)-3-ethoxypyrrolidine

Structural Information

Molecular Formula
C6H13NO
SMILES
CCO[C@H]1CCNC1
InChI
InChI=1S/C6H13NO/c1-2-8-6-3-4-7-5-6/h6-7H,2-5H2,1H3/t6-/m0/s1
InChIKey
KEBOYHJEUFJZPE-LURJTMIESA-N
Compound name
(3S)-3-ethoxypyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

115.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.9
[M+Na]+ 138.08894 134.3
[M+NH4]+ 133.13354 133.3
[M+K]+ 154.06288 130.5
[M-H]- 114.09244 125.1
[M+Na-2H]- 136.07439 129.0
[M]+ 115.09917 125.9
[M]- 115.10027 125.9
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