CID 31480

9-(2-(dimethylamino)ethoxy)anthracene hydrochloride

Structural Information

Molecular Formula
C18H19N
SMILES
CN(C)CCC1=C2C=CC=CC2=CC3=CC=CC=C31
InChI
InChI=1S/C18H19N/c1-19(2)12-11-18-16-9-5-3-7-14(16)13-15-8-4-6-10-17(15)18/h3-10,13H,11-12H2,1-2H3
InChIKey
DETWGLXMQBWYLB-UHFFFAOYSA-N
Compound name
2-anthracen-9-yl-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.15175 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.15903 157.0
[M+Na]+ 272.14097 165.5
[M-H]- 248.14447 163.8
[M+NH4]+ 267.18557 176.9
[M+K]+ 288.11491 160.9
[M+H-H2O]+ 232.14901 149.3
[M+HCOO]- 294.14995 181.1
[M+CH3COO]- 308.16560 170.1
[M+Na-2H]- 270.12642 165.8
[M]+ 249.15120 160.1
[M]- 249.15230 160.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.