CID 22560162

477700-38-2

Structural Information

Molecular Formula
C6H13NO
SMILES
CC(C1CCNC1)O
InChI
InChI=1S/C6H13NO/c1-5(8)6-2-3-7-4-6/h5-8H,2-4H2,1H3
InChIKey
DCTWOTGISQSTGL-UHFFFAOYSA-N
Compound name
1-pyrrolidin-3-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

115.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 125.4
[M+Na]+ 138.08894 133.9
[M+NH4]+ 133.13354 133.4
[M+K]+ 154.06288 131.3
[M-H]- 114.09244 125.0
[M+Na-2H]- 136.07439 128.6
[M]+ 115.09917 126.1
[M]- 115.10027 126.1
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