CID 11936

2-methylanthracene

Structural Information

Molecular Formula
C15H12
SMILES
CC1=CC2=CC3=CC=CC=C3C=C2C=C1
InChI
InChI=1S/C15H12/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-10H,1H3
InChIKey
GYMFBYTZOGMSQJ-UHFFFAOYSA-N
Compound name
2-methylanthracene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

3726
Patents

192.0939 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.101176 138.4
[M+Na]+ 215.083118 149.1
[M-H]- 191.086624 144.6
[M+NH4]+ 210.127723 160.5
[M+K]+ 231.057058 143.9
[M+H-H2O]+ 175.091160 132.0
[M+HCOO]- 237.092101 162.1
[M+CH3COO]- 251.107751 153.0
[M+Na-2H]- 213.068566 149.4
[M]+ 192.09335142 140.0
[M]- 192.09444858 140.0
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