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]+ 219.185576 151.9
[M+Na]+ 241.167518 158.4
[M-H]- 217.171024 156.6
[M+NH4]+ 236.212123 172.5
[M+K]+ 257.141458 154.8
[M+H-H2O]+ 201.175560 144.8
[M+HCOO]- 263.176501 173.4
[M+CH3COO]- 277.192151 191.2
[M+Na-2H]- 239.152966 154.6
[M]+ 218.17775142 148.8
[M]- 218.17884858 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.