CID 83107

1,4-dimethoxyanthracene

Structural Information

Molecular Formula
C16H14O2
SMILES
COC1=CC=C(C2=CC3=CC=CC=C3C=C12)OC
InChI
InChI=1S/C16H14O2/c1-17-15-7-8-16(18-2)14-10-12-6-4-3-5-11(12)9-13(14)15/h3-10H,1-2H3
InChIKey
YCTBFSAWJWMRGO-UHFFFAOYSA-N
Compound name
1,4-dimethoxyanthracene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

296
Patents

238.09938 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.10666 150.6
[M+Na]+ 261.08860 161.4
[M-H]- 237.09210 156.9
[M+NH4]+ 256.13320 170.9
[M+K]+ 277.06254 157.4
[M+H-H2O]+ 221.09664 143.5
[M+HCOO]- 283.09758 174.3
[M+CH3COO]- 297.11323 164.6
[M+Na-2H]- 259.07405 160.2
[M]+ 238.09883 155.8
[M]- 238.09993 155.8
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