CID 96290

1-(2,2-diethoxyethyl)pyrrolidine

Structural Information

Molecular Formula
C10H21NO2
SMILES
CCOC(CN1CCCC1)OCC
InChI
InChI=1S/C10H21NO2/c1-3-12-10(13-4-2)9-11-7-5-6-8-11/h10H,3-9H2,1-2H3
InChIKey
PYFLZPWAPYSHHP-UHFFFAOYSA-N
Compound name
1-(2,2-diethoxyethyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.15723 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.16451 146.1
[M+Na]+ 210.14645 150.5
[M-H]- 186.14995 147.1
[M+NH4]+ 205.19105 166.0
[M+K]+ 226.12039 150.5
[M+H-H2O]+ 170.15449 139.3
[M+HCOO]- 232.15543 166.2
[M+CH3COO]- 246.17108 182.7
[M+Na-2H]- 208.13190 148.1
[M]+ 187.15668 146.9
[M]- 187.15778 146.9
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