CID 4071761

1,8-dichloro-10-methyl-anthracene

Structural Information

Molecular Formula
C15H10Cl2
SMILES
CC1=C2C=CC=C(C2=CC3=C1C=CC=C3Cl)Cl
InChI
InChI=1S/C15H10Cl2/c1-9-10-4-2-6-14(16)12(10)8-13-11(9)5-3-7-15(13)17/h2-8H,1H3
InChIKey
RBPCWJPIOIJAEX-UHFFFAOYSA-N
Compound name
1,8-dichloro-10-methylanthracene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.01596 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.02324 151.8
[M+Na]+ 283.00518 165.4
[M-H]- 259.00868 157.4
[M+NH4]+ 278.04978 172.9
[M+K]+ 298.97912 157.6
[M+H-H2O]+ 243.01322 146.9
[M+HCOO]- 305.01416 165.7
[M+CH3COO]- 319.02981 165.7
[M+Na-2H]- 280.99063 159.8
[M]+ 260.01541 157.7
[M]- 260.01651 157.7
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

No patent data available for this compound.