CID 8418

Anthracene

Structural Information

Molecular Formula
C14H10
SMILES
C1=CC=C2C=C3C=CC=CC3=CC2=C1
InChI
InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H
InChIKey
MWPLVEDNUUSJAV-UHFFFAOYSA-N
Compound name
anthracene
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

5790
References

41973
Patents

178.07825 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.08553 134.7
[M+Na]+ 201.06747 153.1
[M+NH4]+ 196.11207 147.0
[M+K]+ 217.04141 142.7
[M-H]- 177.07097 140.8
[M+Na-2H]- 199.05292 146.1
[M]+ 178.07770 139.5
[M]- 178.07880 139.5
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