CID 2331391

Pyrrolidinemethanol

Structural Information

Molecular Formula
C5H11NO
SMILES
C1CCN(C1)CO
InChI
InChI=1S/C5H11NO/c7-5-6-3-1-2-4-6/h7H,1-5H2
InChIKey
GUFUWKKDHIABBW-UHFFFAOYSA-N
Compound name
pyrrolidin-1-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1913
Patents

101.08406 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.091336 120.4
[M+Na]+ 124.073278 126.8
[M-H]- 100.076784 120.8
[M+NH4]+ 119.117883 143.1
[M+K]+ 140.047218 126.3
[M+H-H2O]+ 84.081320 114.8
[M+HCOO]- 146.082261 141.4
[M+CH3COO]- 160.097911 162.1
[M+Na-2H]- 122.058726 125.8
[M]+ 101.08351142 116.6
[M]- 101.08460858 116.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe