CID 37836

37795-71-4

Structural Information

Molecular Formula

C₁₁H₁₀N₂O₂

SMILES

CC1CON2C1=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C11H10N2O2/c1-7-6-15-13-10(7)12-9-5-3-2-4-8(9)11(13)14/h2-5,7H,6H2,1H3

InChIKey

FASHSDVYBORDDB-UHFFFAOYSA-N

Compound name

3-methyl-2,3-dihydro-[1,2]oxazolo[3,2-b]quinazolin-9-one

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 2
Patents: 202.07423 Da
Monoisotopic Mass: 1.2
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]+	203.08151	140.0
[M+Na]+	225.06345	151.5
[M-H]-	201.06695	144.2
[M+NH4]+	220.10805	159.5
[M+K]+	241.03739	148.9
[M+H-H2O]+	185.07149	133.0
[M+HCOO]-	247.07243	160.0
[M+CH3COO]-	261.08808	154.1
[M+Na-2H]-	223.04890	147.9
[M]+	202.07368	142.5
[M]-	202.07478	142.5

Literature stripe

literature stripe

Patent stripe

patents stripe