CID 3059106

Brn 5584053

Structural Information

Molecular Formula
C17H16N2O2
SMILES
COC1(C2=NC3=CC=CC=C3N2CCO1)C4=CC=CC=C4
InChI
InChI=1S/C17H16N2O2/c1-20-17(13-7-3-2-4-8-13)16-18-14-9-5-6-10-15(14)19(16)11-12-21-17/h2-10H,11-12H2,1H3
InChIKey
YTIWQVWGPAYKQV-UHFFFAOYSA-N
Compound name
1-methoxy-1-phenyl-3,4-dihydro-[1,4]oxazino[4,3-a]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.1212 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.12848 162.9
[M+Na]+ 303.11042 172.9
[M-H]- 279.11392 169.7
[M+NH4]+ 298.15502 180.4
[M+K]+ 319.08436 169.1
[M+H-H2O]+ 263.11846 153.4
[M+HCOO]- 325.11940 182.0
[M+CH3COO]- 339.13505 175.2
[M+Na-2H]- 301.09587 171.1
[M]+ 280.12065 165.2
[M]- 280.12175 165.2
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.