CID 2735486

85387-43-5

Structural Information

Molecular Formula
C13H19NO
SMILES
C1CCN(C(C1)CO)CC2=CC=CC=C2
InChI
InChI=1S/C13H19NO/c15-11-13-8-4-5-9-14(13)10-12-6-2-1-3-7-12/h1-3,6-7,13,15H,4-5,8-11H2
InChIKey
KHPWHJVKPZIZRG-UHFFFAOYSA-N
Compound name
(1-benzylpiperidin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

205.14667 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.15395 148.9
[M+Na]+ 228.13589 161.5
[M+NH4]+ 223.18049 157.9
[M+K]+ 244.10983 153.7
[M-H]- 204.13939 152.7
[M+Na-2H]- 226.12134 156.5
[M]+ 205.14612 151.7
[M]- 205.14722 151.7
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

patents stripe