CID 54595925

(3r)-1-(3-aminopropyl)pyrrolidin-3-ol

Structural Information

Molecular Formula
C7H16N2O
SMILES
C1CN(C[C@@H]1O)CCCN
InChI
InChI=1S/C7H16N2O/c8-3-1-4-9-5-2-7(10)6-9/h7,10H,1-6,8H2/t7-/m1/s1
InChIKey
NDZINGHRTXRLEX-SSDOTTSWSA-N
Compound name
(3R)-1-(3-aminopropyl)pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

144.12627 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.133546 132.8
[M+Na]+ 167.115488 138.4
[M-H]- 143.118994 132.6
[M+NH4]+ 162.160093 153.5
[M+K]+ 183.089428 136.8
[M+H-H2O]+ 127.123530 126.6
[M+HCOO]- 189.124471 153.5
[M+CH3COO]- 203.140121 173.4
[M+Na-2H]- 165.100936 135.8
[M]+ 144.12572142 128.4
[M]- 144.12681858 128.4
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