CID 3050617

66859-76-5

Structural Information

Molecular Formula
C23H30N2
SMILES
CCC(=N)C(CCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H30N2/c1-2-22(24)23(20-12-6-3-7-13-20,21-14-8-4-9-15-21)16-19-25-17-10-5-11-18-25/h3-4,6-9,12-15,24H,2,5,10-11,16-19H2,1H3
InChIKey
YVJNVHVNGQLNOY-UHFFFAOYSA-N
Compound name
4,4-diphenyl-6-piperidin-1-ylhexan-3-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.2409 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.24818 183.9
[M+Na]+ 357.23012 184.2
[M-H]- 333.23362 189.6
[M+NH4]+ 352.27472 194.4
[M+K]+ 373.20406 178.2
[M+H-H2O]+ 317.23816 173.4
[M+HCOO]- 379.23910 199.4
[M+CH3COO]- 393.25475 213.8
[M+Na-2H]- 355.21557 186.7
[M]+ 334.24035 177.0
[M]- 334.24145 177.0
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.