CID 14784825

(3s,4s)-3,4-dimethoxypyrrolidine;hydrochloride

Structural Information

Molecular Formula
C6H13NO2
SMILES
CO[C@H]1CNC[C@@H]1OC
InChI
InChI=1S/C6H13NO2/c1-8-5-3-7-4-6(5)9-2/h5-7H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKey
CROOPTGQTSCWCM-WDSKDSINSA-N
Compound name
(3S,4S)-3,4-dimethoxypyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

98
Patents

131.09464 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 127.3
[M+Na]+ 154.08386 134.2
[M-H]- 130.08736 127.9
[M+NH4]+ 149.12846 149.1
[M+K]+ 170.05780 133.8
[M+H-H2O]+ 114.09190 121.7
[M+HCOO]- 176.09284 148.2
[M+CH3COO]- 190.10849 168.2
[M+Na-2H]- 152.06931 131.5
[M]+ 131.09409 125.8
[M]- 131.09519 125.8
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.