CID 22391

Norpipanone

Structural Information

Molecular Formula
C23H29NO
SMILES
CCC(=O)C(CCN1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H29NO/c1-2-22(25)23(20-12-6-3-7-13-20,21-14-8-4-9-15-21)16-19-24-17-10-5-11-18-24/h3-4,6-9,12-15H,2,5,10-11,16-19H2,1H3
InChIKey
WCDSHELZWCOTMI-UHFFFAOYSA-N
Compound name
4,4-diphenyl-6-piperidin-1-ylhexan-3-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

7403
Patents

335.2249 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.23218 186.2
[M+Na]+ 358.21412 199.2
[M+NH4]+ 353.25872 194.4
[M+K]+ 374.18806 190.2
[M-H]- 334.21762 191.9
[M+Na-2H]- 356.19957 195.6
[M]+ 335.22435 189.8
[M]- 335.22545 189.8
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

patents stripe