CID 48124

9,10-dihydro-9-anthroic acid (2-morpholinoethyl) ester, hydrochloride

Structural Information

Molecular Formula
C21H23NO3
SMILES
C1COCCN1CCOC(=O)C2C3=CC=CC=C3CC4=CC=CC=C24
InChI
InChI=1S/C21H23NO3/c23-21(25-14-11-22-9-12-24-13-10-22)20-18-7-3-1-5-16(18)15-17-6-2-4-8-19(17)20/h1-8,20H,9-15H2
InChIKey
BKSRPSWFNHNTSX-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylethyl 9,10-dihydroanthracene-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

337.1678 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.17508 181.2
[M+Na]+ 360.15702 195.2
[M+NH4]+ 355.20162 190.0
[M+K]+ 376.13096 186.7
[M-H]- 336.16052 187.4
[M+Na-2H]- 358.14247 187.1
[M]+ 337.16725 185.0
[M]- 337.16835 185.0
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

patents stripe