CID 21538963

1-aminopyrrolidin-3-ol

Structural Information

Molecular Formula
C4H10N2O
SMILES
C1CN(CC1O)N
InChI
InChI=1S/C4H10N2O/c5-6-2-1-4(7)3-6/h4,7H,1-3,5H2
InChIKey
BXAIQPPVOCFPQA-UHFFFAOYSA-N
Compound name
1-aminopyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

102.079315 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.08659 119.2
[M+Na]+ 125.06853 126.2
[M-H]- 101.07204 119.6
[M+NH4]+ 120.11314 141.6
[M+K]+ 141.04247 125.3
[M+H-H2O]+ 85.076575 113.6
[M+HCOO]- 147.07752 141.0
[M+CH3COO]- 161.09317 164.3
[M+Na-2H]- 123.05398 123.8
[M]+ 102.07877 113.7
[M]- 102.07986 113.7
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