CID 21191123

1-methylpyrrolidine-3-ethanol

Structural Information

Molecular Formula
C7H15NO
SMILES
CN1CCC(C1)CCO
InChI
InChI=1S/C7H15NO/c1-8-4-2-7(6-8)3-5-9/h7,9H,2-6H2,1H3
InChIKey
HRVHWDLLWKMHNT-UHFFFAOYSA-N
Compound name
2-(1-methylpyrrolidin-3-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

129.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 128.8
[M+Na]+ 152.10459 138.4
[M+NH4]+ 147.14919 137.1
[M+K]+ 168.07853 134.6
[M-H]- 128.10809 129.1
[M+Na-2H]- 150.09004 132.5
[M]+ 129.11482 129.9
[M]- 129.11592 129.9
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