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]+ 308.16451 172.0
[M+Na]+ 330.14645 179.3
[M-H]- 306.14995 179.0
[M+NH4]+ 325.19105 185.8
[M+K]+ 346.12039 175.0
[M+H-H2O]+ 290.15449 161.8
[M+HCOO]- 352.15543 188.8
[M+CH3COO]- 366.17108 182.6
[M+Na-2H]- 328.13190 179.0
[M]+ 307.15668 172.3
[M]- 307.15778 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.