CID 58324

101418-15-9

Structural Information

Molecular Formula
C19H21NO3
SMILES
CN1CCC(CC1)(C2=CC=CC=C2)OC(=O)OC3=CC=CC=C3
InChI
InChI=1S/C19H21NO3/c1-20-14-12-19(13-15-20,16-8-4-2-5-9-16)23-18(21)22-17-10-6-3-7-11-17/h2-11H,12-15H2,1H3
InChIKey
JAWVTCCRYNKTAD-UHFFFAOYSA-N
Compound name
(1-methyl-4-phenylpiperidin-4-yl) phenyl carbonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

311.15213 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.159406 175.1
[M+Na]+ 334.141348 179.5
[M-H]- 310.144854 182.4
[M+NH4]+ 329.185953 189.2
[M+K]+ 350.115288 176.2
[M+H-H2O]+ 294.149390 165.0
[M+HCOO]- 356.150331 193.2
[M+CH3COO]- 370.165981 202.1
[M+Na-2H]- 332.126796 178.9
[M]+ 311.15158142 172.7
[M]- 311.15267858 172.7
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.