CID 207770

30764-69-3

Structural Information

Molecular Formula
C12H18N2
SMILES
CCN[C@H]1CCN(C1)C2=CC=CC=C2
InChI
InChI=1S/C12H18N2/c1-2-13-11-8-9-14(10-11)12-6-4-3-5-7-12/h3-7,11,13H,2,8-10H2,1H3/t11-/m0/s1
InChIKey
SUKLAXLXOKENAK-NSHDSACASA-N
Compound name
(3S)-N-ethyl-1-phenylpyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

190.147 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.15428 143.3
[M+Na]+ 213.13622 148.7
[M-H]- 189.13972 148.0
[M+NH4]+ 208.18082 162.8
[M+K]+ 229.11016 145.7
[M+H-H2O]+ 173.14426 135.5
[M+HCOO]- 235.14520 166.0
[M+CH3COO]- 249.16085 185.2
[M+Na-2H]- 211.12167 147.6
[M]+ 190.14645 139.7
[M]- 190.14755 139.7
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.