CID 3064338

4-piperidinol, 1-(cyclopropylmethyl)-4-phenyl-

Structural Information

Molecular Formula
C15H21NO
SMILES
C1CC1CN2CCC(CC2)(C3=CC=CC=C3)O
InChI
InChI=1S/C15H21NO/c17-15(14-4-2-1-3-5-14)8-10-16(11-9-15)12-13-6-7-13/h1-5,13,17H,6-12H2
InChIKey
CSCQALNSHOPTLB-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)-4-phenylpiperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.16231 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.16959 155.5
[M+Na]+ 254.15153 161.9
[M-H]- 230.15503 162.3
[M+NH4]+ 249.19613 168.1
[M+K]+ 270.12547 158.6
[M+H-H2O]+ 214.15957 147.7
[M+HCOO]- 276.16051 173.2
[M+CH3COO]- 290.17616 166.0
[M+Na-2H]- 252.13698 160.2
[M]+ 231.16176 152.7
[M]- 231.16286 152.7
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.