CID 113858

63765-71-9

Structural Information

Molecular Formula
C16H15NO
SMILES
C1=CC=C2C(=C1)C=CC3=C2C=CC(=C3)C(CN)O
InChI
InChI=1S/C16H15NO/c17-10-16(18)13-7-8-15-12(9-13)6-5-11-3-1-2-4-14(11)15/h1-9,16,18H,10,17H2
InChIKey
UWMSFKCJEMVSTJ-UHFFFAOYSA-N
Compound name
2-amino-1-phenanthren-2-ylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.11537 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.12265 151.4
[M+Na]+ 260.10459 159.9
[M-H]- 236.10809 155.4
[M+NH4]+ 255.14919 170.2
[M+K]+ 276.07853 154.4
[M+H-H2O]+ 220.11263 144.8
[M+HCOO]- 282.11357 172.8
[M+CH3COO]- 296.12922 163.7
[M+Na-2H]- 258.09004 159.7
[M]+ 237.11482 150.8
[M]- 237.11592 150.8
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

No patent data available for this compound.