CID 75531143

Rac-(3r,4r)-4-(morpholin-4-yl)pyrrolidin-3-ol dihydrochloride

Structural Information

Molecular Formula
C8H16N2O2
SMILES
C1COCCN1[C@@H]2CNC[C@H]2O
InChI
InChI=1S/C8H16N2O2/c11-8-6-9-5-7(8)10-1-3-12-4-2-10/h7-9,11H,1-6H2/t7-,8-/m1/s1
InChIKey
XTYNAFYREQNMKG-HTQZYQBOSA-N
Compound name
(3R,4R)-4-morpholin-4-ylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

172.12119 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.128466 139.3
[M+Na]+ 195.110408 143.2
[M-H]- 171.113914 139.9
[M+NH4]+ 190.155013 155.3
[M+K]+ 211.084348 142.0
[M+H-H2O]+ 155.118450 131.8
[M+HCOO]- 217.119391 152.9
[M+CH3COO]- 231.135041 171.2
[M+Na-2H]- 193.095856 141.8
[M]+ 172.12064142 130.9
[M]- 172.12173858 130.9
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

No patent data available for this compound.