CID 91647527

(3s,5r)-5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-ol hydrochloride

Structural Information

Molecular Formula
C8H13N3O2
SMILES
CCC1=NOC(=N1)[C@H]2C[C@@H](CN2)O
InChI
InChI=1S/C8H13N3O2/c1-2-7-10-8(13-11-7)6-3-5(12)4-9-6/h5-6,9,12H,2-4H2,1H3/t5-,6+/m0/s1
InChIKey
CWEGJDPWSAGFTA-NTSWFWBYSA-N
Compound name
(3S,5R)-5-(3-ethyl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.10077 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.10805 139.8
[M+Na]+ 206.08999 149.4
[M+NH4]+ 201.13459 146.1
[M+K]+ 222.06393 149.4
[M-H]- 182.09349 140.6
[M+Na-2H]- 204.07544 143.0
[M]+ 183.10022 141.0
[M]- 183.10132 141.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.