CID 13076

9,10-dimethylanthracene

Structural Information

Molecular Formula
C16H14
SMILES
CC1=C2C=CC=CC2=C(C3=CC=CC=C13)C
InChI
InChI=1S/C16H14/c1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16/h3-10H,1-2H3
InChIKey
JTGMTYWYUZDRBK-UHFFFAOYSA-N
Compound name
9,10-dimethylanthracene
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

76
References

3208
Patents

206.10954 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11682 143.4
[M+Na]+ 229.09876 162.2
[M+NH4]+ 224.14336 155.4
[M+K]+ 245.07270 151.7
[M-H]- 205.10226 149.6
[M+Na-2H]- 227.08421 153.9
[M]+ 206.10899 148.4
[M]- 206.11009 148.4
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