CID 24844928

88799-56-8

Structural Information

Molecular Formula
C17H20N2O2
SMILES
CCC1C(=O)C(C2=COC=CN2N1)CCC3=CC=CC=C3
InChI
InChI=1S/C17H20N2O2/c1-2-15-17(20)14(9-8-13-6-4-3-5-7-13)16-12-21-11-10-19(16)18-15/h3-7,10-12,14-15,18H,2,8-9H2,1H3
InChIKey
KNNXBGSYELSNTQ-UHFFFAOYSA-N
Compound name
2-ethyl-4-(2-phenylethyl)-2,4-dihydro-1H-pyridazino[6,1-c][1,4]oxazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.15247 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.15975 168.8
[M+Na]+ 307.14169 183.0
[M+NH4]+ 302.18629 176.5
[M+K]+ 323.11563 175.1
[M-H]- 283.14519 173.4
[M+Na-2H]- 305.12714 174.6
[M]+ 284.15192 172.1
[M]- 284.15302 172.1
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.