CID 22731064

5-(aminomethyl)-1-methylpyrrolidin-3-ol

Structural Information

Molecular Formula
C6H14N2O
SMILES
CN1CC(CC1CN)O
InChI
InChI=1S/C6H14N2O/c1-8-4-6(9)2-5(8)3-7/h5-6,9H,2-4,7H2,1H3
InChIKey
ZPOXBKJTQMEVHK-UHFFFAOYSA-N
Compound name
5-(aminomethyl)-1-methylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

130.11061 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.11789 127.5
[M+Na]+ 153.09983 136.0
[M+NH4]+ 148.14443 135.2
[M+K]+ 169.07377 133.4
[M-H]- 129.10333 127.9
[M+Na-2H]- 151.08528 130.5
[M]+ 130.11006 128.3
[M]- 130.11116 128.3
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.