CID 17389989

[1-(2-methoxyethyl)pyrrolidin-3-yl]methanamine

Structural Information

Molecular Formula
C8H18N2O
SMILES
COCCN1CCC(C1)CN
InChI
InChI=1S/C8H18N2O/c1-11-5-4-10-3-2-8(6-9)7-10/h8H,2-7,9H2,1H3
InChIKey
SVWDIDWSZJLAMB-UHFFFAOYSA-N
Compound name
[1-(2-methoxyethyl)pyrrolidin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

158.1419 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.149176 136.7
[M+Na]+ 181.131118 142.4
[M-H]- 157.134624 137.8
[M+NH4]+ 176.175723 157.6
[M+K]+ 197.105058 141.4
[M+H-H2O]+ 141.139160 130.1
[M+HCOO]- 203.140101 158.7
[M+CH3COO]- 217.155751 179.1
[M+Na-2H]- 179.116566 139.7
[M]+ 158.14135142 134.6
[M]- 158.14244858 134.6
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