CID 10129930

1-(pyrrolidin-2-yl)ethan-1-ol

Structural Information

Molecular Formula
C6H13NO
SMILES
CC(C1CCCN1)O
InChI
InChI=1S/C6H13NO/c1-5(8)6-3-2-4-7-6/h5-8H,2-4H2,1H3
InChIKey
IEBYUZARWOFDSE-UHFFFAOYSA-N
Compound name
1-pyrrolidin-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

386
Patents

115.09972 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.106996 126.4
[M+Na]+ 138.088938 131.7
[M-H]- 114.092444 125.3
[M+NH4]+ 133.133543 147.8
[M+K]+ 154.062878 130.4
[M+H-H2O]+ 98.096980 120.9
[M+HCOO]- 160.097921 144.6
[M+CH3COO]- 174.113571 163.3
[M+Na-2H]- 136.074386 129.4
[M]+ 115.09917142 120.4
[M]- 115.10026858 120.4
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