CID 165946435

2703781-82-0

Structural Information

Molecular Formula
C14H22N2
SMILES
CCC1(CC(CN1CC2=CC=CC=C2)N)C
InChI
InChI=1S/C14H22N2/c1-3-14(2)9-13(15)11-16(14)10-12-7-5-4-6-8-12/h4-8,13H,3,9-11,15H2,1-2H3
InChIKey
VKHRBAUTMOWLOD-UHFFFAOYSA-N
Compound name
1-benzyl-5-ethyl-5-methylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1783 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.18558 151.9
[M+Na]+ 241.16752 158.4
[M-H]- 217.17102 156.6
[M+NH4]+ 236.21212 172.5
[M+K]+ 257.14146 154.8
[M+H-H2O]+ 201.17556 144.8
[M+HCOO]- 263.17650 173.4
[M+CH3COO]- 277.19215 191.2
[M+Na-2H]- 239.15297 154.6
[M]+ 218.17775 148.8
[M]- 218.17885 148.8
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

No patent data available for this compound.