CID 206098

Xanthen-9-one, 4-methoxy-3-morpholinomethyl-, hydrochloride

Structural Information

Molecular Formula
C19H19NO4
SMILES
COC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)CN4CCOCC4
InChI
InChI=1S/C19H19NO4/c1-22-18-13(12-20-8-10-23-11-9-20)6-7-15-17(21)14-4-2-3-5-16(14)24-19(15)18/h2-7H,8-12H2,1H3
InChIKey
FLAHJEOYFZLSSP-UHFFFAOYSA-N
Compound name
4-methoxy-3-(morpholin-4-ylmethyl)xanthen-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.1314 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.13868 174.0
[M+Na]+ 348.12062 191.2
[M+NH4]+ 343.16522 182.6
[M+K]+ 364.09456 183.1
[M-H]- 324.12412 181.8
[M+Na-2H]- 346.10607 181.0
[M]+ 325.13085 179.0
[M]- 325.13195 179.0
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

No patent data available for this compound.