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]+ 275.24818 170.6
[M+Na]+ 297.23012 171.7
[M-H]- 273.23362 173.8
[M+NH4]+ 292.27472 184.5
[M+K]+ 313.20406 168.2
[M+H-H2O]+ 257.23816 161.8
[M+HCOO]- 319.23910 186.4
[M+CH3COO]- 333.25475 203.1
[M+Na-2H]- 295.21557 173.4
[M]+ 274.24035 165.3
[M]- 274.24145 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.