CID 55300116

2044705-91-9

Structural Information

Molecular Formula
C7H13NO
SMILES
C1C[C@H]([C@@H]2[C@H]1CCN2)O
InChI
InChI=1S/C7H13NO/c9-6-2-1-5-3-4-8-7(5)6/h5-9H,1-4H2/t5-,6-,7+/m1/s1
InChIKey
RVUBHWGJRCJPSK-QYNIQEEDSA-N
Compound name
(3aR,6R,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrol-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

127.09972 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.10700 127.1
[M+Na]+ 150.08894 135.1
[M+NH4]+ 145.13354 136.0
[M+K]+ 166.06288 133.8
[M-H]- 126.09244 127.0
[M+Na-2H]- 148.07439 129.0
[M]+ 127.09917 127.8
[M]- 127.10027 127.8
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.