CID 7577799

153837-28-6

Structural Information

Molecular Formula
C18H30N2
SMILES
CC(C)(C)CN[C@@H](CN1CCCCC1)C2=CC=CC=C2
InChI
InChI=1S/C18H30N2/c1-18(2,3)15-19-17(16-10-6-4-7-11-16)14-20-12-8-5-9-13-20/h4,6-7,10-11,17,19H,5,8-9,12-15H2,1-3H3/t17-/m0/s1
InChIKey
RUWFXOINQANLGF-KRWDZBQOSA-N
Compound name
2,2-dimethyl-N-[(1R)-1-phenyl-2-piperidin-1-ylethyl]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.2409 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.248176 170.6
[M+Na]+ 297.230118 171.7
[M-H]- 273.233624 173.8
[M+NH4]+ 292.274723 184.5
[M+K]+ 313.204058 168.2
[M+H-H2O]+ 257.238160 161.8
[M+HCOO]- 319.239101 186.4
[M+CH3COO]- 333.254751 203.1
[M+Na-2H]- 295.215566 173.4
[M]+ 274.24035142 165.3
[M]- 274.24144858 165.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.