CID 27069

6-(2-aminoethyl)-3-biphenylol hydrochloride

Structural Information

Molecular Formula
C14H15NO
SMILES
C1=CC=C(C=C1)C2=C(C=CC(=C2)O)CCN
InChI
InChI=1S/C14H15NO/c15-9-8-12-6-7-13(16)10-14(12)11-4-2-1-3-5-11/h1-7,10,16H,8-9,15H2
InChIKey
JMODMPREATUHFF-UHFFFAOYSA-N
Compound name
4-(2-aminoethyl)-3-phenylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.11537 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.12265 147.5
[M+Na]+ 236.10459 154.8
[M-H]- 212.10809 152.7
[M+NH4]+ 231.14919 165.1
[M+K]+ 252.07853 150.1
[M+H-H2O]+ 196.11263 140.6
[M+HCOO]- 258.11357 171.1
[M+CH3COO]- 272.12922 188.0
[M+Na-2H]- 234.09004 153.1
[M]+ 213.11482 145.3
[M]- 213.11592 145.3
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.