CID 5317836

37551-75-0

Structural Information

Molecular Formula
C19H19NO5
SMILES
CC(CO)(C1CC2=C(O1)C=C(C3=C2N(C4=CC=CC=C4C3=O)C)O)O
InChI
InChI=1S/C19H19NO5/c1-19(24,9-21)15-7-11-14(25-15)8-13(22)16-17(11)20(2)12-6-4-3-5-10(12)18(16)23/h3-6,8,15,21-22,24H,7,9H2,1-2H3
InChIKey
RQAGSTDFTGSIGB-UHFFFAOYSA-N
Compound name
2-(1,2-dihydroxypropan-2-yl)-5-hydroxy-11-methyl-1,2-dihydrofuro[2,3-c]acridin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

341.1263 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.133576 178.8
[M+Na]+ 364.115518 189.7
[M-H]- 340.119024 182.1
[M+NH4]+ 359.160123 193.3
[M+K]+ 380.089458 185.5
[M+H-H2O]+ 324.123560 172.9
[M+HCOO]- 386.124501 192.4
[M+CH3COO]- 400.140151 189.6
[M+Na-2H]- 362.100966 184.5
[M]+ 341.12575142 183.4
[M]- 341.12684858 183.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.