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

17
Patents

158.1419 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.14918 136.7
[M+Na]+ 181.13112 142.4
[M-H]- 157.13462 137.8
[M+NH4]+ 176.17572 157.6
[M+K]+ 197.10506 141.4
[M+H-H2O]+ 141.13916 130.1
[M+HCOO]- 203.14010 158.7
[M+CH3COO]- 217.15575 179.1
[M+Na-2H]- 179.11657 139.7
[M]+ 158.14135 134.6
[M]- 158.14245 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