CID 10229

Phenanthren-9-ol

Structural Information

Molecular Formula
C14H10O
SMILES
C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)O
InChI
InChI=1S/C14H10O/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9,15H
InChIKey
DZKIUEHLEXLYKM-UHFFFAOYSA-N
Compound name
phenanthren-9-ol
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

117
References

5453
Patents

194.07317 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.080446 137.5
[M+Na]+ 217.062388 148.1
[M-H]- 193.065894 142.5
[M+NH4]+ 212.106993 158.7
[M+K]+ 233.036328 142.9
[M+H-H2O]+ 177.070430 131.4
[M+HCOO]- 239.071371 160.3
[M+CH3COO]- 253.087021 151.7
[M+Na-2H]- 215.047836 148.7
[M]+ 194.07262142 138.5
[M]- 194.07371858 138.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe