CID 12258425

Phenyl(piperidin-3-yl)methanol hydrochloride

Structural Information

Molecular Formula
C12H17NO
SMILES
C1CC(CNC1)C(C2=CC=CC=C2)O
InChI
InChI=1S/C12H17NO/c14-12(10-5-2-1-3-6-10)11-7-4-8-13-9-11/h1-3,5-6,11-14H,4,7-9H2
InChIKey
LRMSJSMBPXSCCK-UHFFFAOYSA-N
Compound name
phenyl(piperidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

191.13101 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.13829 144.2
[M+Na]+ 214.12023 147.4
[M-H]- 190.12373 145.5
[M+NH4]+ 209.16483 160.2
[M+K]+ 230.09417 143.6
[M+H-H2O]+ 174.12827 136.8
[M+HCOO]- 236.12921 159.8
[M+CH3COO]- 250.14486 177.4
[M+Na-2H]- 212.10568 148.2
[M]+ 191.13046 135.8
[M]- 191.13156 135.8
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