CID 14690414

162679-02-9

Structural Information

Molecular Formula
C8H15NO
SMILES
C1C[C@H]2C[C@H](N[C@H]2C1)CO
InChI
InChI=1S/C8H15NO/c10-5-7-4-6-2-1-3-8(6)9-7/h6-10H,1-5H2/t6-,7-,8-/m0/s1
InChIKey
XXKIUXSAULZREZ-FXQIFTODSA-N
Compound name
[(2S,3aS,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrol-2-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

141.11537 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.12265 133.1
[M+Na]+ 164.10459 139.1
[M-H]- 140.10809 133.0
[M+NH4]+ 159.14919 156.4
[M+K]+ 180.07853 136.5
[M+H-H2O]+ 124.11263 128.0
[M+HCOO]- 186.11357 150.8
[M+CH3COO]- 200.12922 167.9
[M+Na-2H]- 162.09004 135.2
[M]+ 141.11482 127.2
[M]- 141.11592 127.2
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