CID 299494

Ar-d38 2,7-dimethoxyphenanthrene

Structural Information

Molecular Formula
C16H14O2
SMILES
COC1=CC2=C(C=C1)C3=C(C=C2)C=C(C=C3)OC
InChI
InChI=1S/C16H14O2/c1-17-13-5-7-15-11(9-13)3-4-12-10-14(18-2)6-8-16(12)15/h3-10H,1-2H3
InChIKey
FVLTYIFHOFYVKK-UHFFFAOYSA-N
Compound name
2,7-dimethoxyphenanthrene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
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