CID 3053762

70385-03-4

Structural Information

Molecular Formula
C16H20N2O3
SMILES
CN1CCC23C(C1)C(CC(=O)N2)C4=C(O3)C=CC(=C4)OC
InChI
InChI=1S/C16H20N2O3/c1-18-6-5-16-13(9-18)11(8-15(19)17-16)12-7-10(20-2)3-4-14(12)21-16/h3-4,7,11,13H,5-6,8-9H2,1-2H3,(H,17,19)
InChIKey
IUDIYMVJARXVGM-UHFFFAOYSA-N
Compound name
6-methoxy-12-methyl-2-oxa-12,15-diazatetracyclo[7.5.3.01,10.03,8]heptadeca-3(8),4,6-trien-16-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.1474 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.15468 169.2
[M+Na]+ 311.13662 181.8
[M+NH4]+ 306.18122 178.9
[M+K]+ 327.11056 173.1
[M-H]- 287.14012 172.5
[M+Na-2H]- 309.12207 172.2
[M]+ 288.14685 172.0
[M]- 288.14795 172.0
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.