CID 131100604

1-[(1s,2r)-2-aminocyclopentyl]pyrrolidin-3-ol

Structural Information

Molecular Formula
C9H18N2O
SMILES
C1C[C@H]([C@H](C1)N2CCC(C2)O)N
InChI
InChI=1S/C9H18N2O/c10-8-2-1-3-9(8)11-5-4-7(12)6-11/h7-9,12H,1-6,10H2/t7?,8-,9+/m1/s1
InChIKey
RZBGJUJJPGPALM-ASODMVGOSA-N
Compound name
1-[(1S,2R)-2-aminocyclopentyl]pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.1419 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.14918 139.7
[M+Na]+ 193.13112 144.5
[M-H]- 169.13462 142.8
[M+NH4]+ 188.17572 160.9
[M+K]+ 209.10506 142.5
[M+H-H2O]+ 153.13916 133.2
[M+HCOO]- 215.14010 159.2
[M+CH3COO]- 229.15575 177.3
[M+Na-2H]- 191.11657 139.1
[M]+ 170.14135 131.9
[M]- 170.14245 131.9
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.