CID 3040638

Morpholine, 4-((2-methoxy-1-anthracenyl)methyl)-, hydrochloride

Structural Information

Molecular Formula
C20H21NO2
SMILES
COC1=C(C2=CC3=CC=CC=C3C=C2C=C1)CN4CCOCC4
InChI
InChI=1S/C20H21NO2/c1-22-20-7-6-17-12-15-4-2-3-5-16(15)13-18(17)19(20)14-21-8-10-23-11-9-21/h2-7,12-13H,8-11,14H2,1H3
InChIKey
FALQAKLMISQVLD-UHFFFAOYSA-N
Compound name
4-[(2-methoxyanthracen-1-yl)methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.15723 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.164506 172.0
[M+Na]+ 330.146448 179.3
[M-H]- 306.149954 179.0
[M+NH4]+ 325.191053 185.8
[M+K]+ 346.120388 175.0
[M+H-H2O]+ 290.154490 161.8
[M+HCOO]- 352.155431 188.8
[M+CH3COO]- 366.171081 182.6
[M+Na-2H]- 328.131896 179.0
[M]+ 307.15668142 172.3
[M]- 307.15777858 172.3
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.