CID 268108

90227-42-2

Structural Information

Molecular Formula
C8H17NO2
SMILES
COCCN1CCC(C1)CO
InChI
InChI=1S/C8H17NO2/c1-11-5-4-9-3-2-8(6-9)7-10/h8,10H,2-7H2,1H3
InChIKey
ZVBJMUVVMBASLP-UHFFFAOYSA-N
Compound name
[1-(2-methoxyethyl)pyrrolidin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

69
Patents

159.12593 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.13321 136.3
[M+Na]+ 182.11515 145.2
[M+NH4]+ 177.15975 143.8
[M+K]+ 198.08909 141.7
[M-H]- 158.11865 136.0
[M+Na-2H]- 180.10060 139.3
[M]+ 159.12538 137.1
[M]- 159.12648 137.1
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