CID 3053072

6h-dibenz(b,f)oxiren(d)azepine-6-glyoxylamide, 1a,10b-dihydro-

Structural Information

Molecular Formula
C16H12N2O3
SMILES
C1=CC=C2C(=C1)C3C(O3)C4=CC=CC=C4N2C(=O)C(=O)N
InChI
InChI=1S/C16H12N2O3/c17-15(19)16(20)18-11-7-3-1-5-9(11)13-14(21-13)10-6-2-4-8-12(10)18/h1-8,13-14H,(H2,17,19)
InChIKey
DWTSKYRANJXCKJ-UHFFFAOYSA-N
Compound name
2-(3-oxa-11-azatetracyclo[10.4.0.02,4.05,10]hexadeca-1(16),5,7,9,12,14-hexaen-11-yl)-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.08478 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.09206 163.0
[M+Na]+ 303.07400 175.6
[M+NH4]+ 298.11860 170.8
[M+K]+ 319.04794 172.4
[M-H]- 279.07750 172.5
[M+Na-2H]- 301.05945 168.8
[M]+ 280.08423 168.5
[M]- 280.08533 168.5
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.