CID 37263

35793-87-4

Structural Information

Molecular Formula

C₁₀H₁₂N₂O₂

SMILES

CCC1NC(=O)C2=C(O1)C=CC(=C2)N

InChI

InChI=1S/C10H12N2O2/c1-2-9-12-10(13)7-5-6(11)3-4-8(7)14-9/h3-5,9H,2,11H2,1H3,(H,12,13)

InChIKey

KFXTUQBOKKTTEP-UHFFFAOYSA-N

Compound name

6-amino-2-ethyl-2,3-dihydro-1,3-benzoxazin-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 192.08987 Da
Monoisotopic Mass: 1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	193.09715	140.7
[M+Na]+	215.07909	152.9
[M+NH4]+	210.12369	148.6
[M+K]+	231.05303	147.4
[M-H]-	191.08259	143.8
[M+Na-2H]-	213.06454	144.9
[M]+	192.08932	143.1
[M]-	192.09042	143.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe