CID 12691880

3-ethyl-3-methylpyrrolidine

Structural Information

Molecular Formula
C7H15N
SMILES
CCC1(CCNC1)C
InChI
InChI=1S/C7H15N/c1-3-7(2)4-5-8-6-7/h8H,3-6H2,1-2H3
InChIKey
DWEXCXIEVRCDTE-UHFFFAOYSA-N
Compound name
3-ethyl-3-methylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

113.12045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.127726 125.5
[M+Na]+ 136.109668 132.1
[M-H]- 112.113174 126.0
[M+NH4]+ 131.154273 149.9
[M+K]+ 152.083608 130.8
[M+H-H2O]+ 96.117710 120.6
[M+HCOO]- 158.118651 145.8
[M+CH3COO]- 172.134301 165.8
[M+Na-2H]- 134.095116 131.0
[M]+ 113.11990142 121.4
[M]- 113.12099858 121.4
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