CID 68063

Anthracene-1,4,9,10-tetraol

Structural Information

Molecular Formula
C14H10O4
SMILES
C1=CC=C2C(=C1)C(=C3C(=CC=C(C3=C2O)O)O)O
InChI
InChI=1S/C14H10O4/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,15-18H
InChIKey
BKNBVEKCHVXGPH-UHFFFAOYSA-N
Compound name
anthracene-1,4,9,10-tetrol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

1010
Patents

242.0579 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.06518 149.5
[M+Na]+ 265.04712 165.3
[M+NH4]+ 260.09172 158.0
[M+K]+ 281.02106 158.9
[M-H]- 241.05062 151.8
[M+Na-2H]- 263.03257 155.6
[M]+ 242.05735 152.5
[M]- 242.05845 152.5
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