CID 366826

Nsc635598

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CCN(CC)CC(=O)NC1C2=CC=CC=C2OC3=C(C=CC=C13)C
InChI
InChI=1S/C20H24N2O2/c1-4-22(5-2)13-18(23)21-19-15-10-6-7-12-17(15)24-20-14(3)9-8-11-16(19)20/h6-12,19H,4-5,13H2,1-3H3,(H,21,23)
InChIKey
MUWUAXSKRJVAGF-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(4-methyl-9H-xanthen-9-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.19106 179.1
[M+Na]+ 347.17300 184.6
[M-H]- 323.17650 185.7
[M+NH4]+ 342.21760 194.1
[M+K]+ 363.14694 182.3
[M+H-H2O]+ 307.18104 170.5
[M+HCOO]- 369.18198 199.1
[M+CH3COO]- 383.19763 220.2
[M+Na-2H]- 345.15845 184.1
[M]+ 324.18323 181.8
[M]- 324.18433 181.8
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.