CID 21065334

1-(2-aminoethyl)-3-pyrrolidinol

Structural Information

Molecular Formula
C6H14N2O
SMILES
C1CN(CC1O)CCN
InChI
InChI=1S/C6H14N2O/c7-2-4-8-3-1-6(9)5-8/h6,9H,1-5,7H2
InChIKey
ZNLCTCNYKCENHP-UHFFFAOYSA-N
Compound name
1-(2-aminoethyl)pyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

135
Patents

130.11061 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.11789 128.3
[M+Na]+ 153.09983 134.4
[M-H]- 129.10333 128.3
[M+NH4]+ 148.14443 149.5
[M+K]+ 169.07377 133.0
[M+H-H2O]+ 113.10787 122.3
[M+HCOO]- 175.10881 149.4
[M+CH3COO]- 189.12446 170.4
[M+Na-2H]- 151.08528 131.8
[M]+ 130.11006 123.5
[M]- 130.11116 123.5
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