CID 198608

83898-26-4

Structural Information

Molecular Formula
C19H23NO
SMILES
CC1=CC=C(C=C1)C2(CCN(CC2)CC3=CC=CC=C3)O
InChI
InChI=1S/C19H23NO/c1-16-7-9-18(10-8-16)19(21)11-13-20(14-12-19)15-17-5-3-2-4-6-17/h2-10,21H,11-15H2,1H3
InChIKey
AZGNTLLAVWZVIQ-UHFFFAOYSA-N
Compound name
1-benzyl-4-(4-methylphenyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

281.17798 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.18526 169.2
[M+Na]+ 304.16720 174.3
[M-H]- 280.17070 175.4
[M+NH4]+ 299.21180 184.4
[M+K]+ 320.14114 168.9
[M+H-H2O]+ 264.17524 159.8
[M+HCOO]- 326.17618 186.3
[M+CH3COO]- 340.19183 179.1
[M+Na-2H]- 302.15265 173.0
[M]+ 281.17743 164.1
[M]- 281.17853 164.1
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

patents stripe