CID 69398299

(3,4-dihydro-2h-benzo[b][1,4]oxazin-5-yl)methanol

Structural Information

Molecular Formula

C₉H₁₁NO₂

SMILES

C1COC2=CC=CC(=C2N1)CO

InChI

InChI=1S/C9H11NO2/c11-6-7-2-1-3-8-9(7)10-4-5-12-8/h1-3,10-11H,4-6H2

InChIKey

PFNAQMAQQWVXIJ-UHFFFAOYSA-N

Compound name

3,4-dihydro-2H-1,4-benzoxazin-5-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 165.07898 Da
Monoisotopic Mass: 0.8
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]+	166.08626	133.4
[M+Na]+	188.06820	146.1
[M+NH4]+	183.11280	142.1
[M+K]+	204.04214	140.2
[M-H]-	164.07170	136.1
[M+Na-2H]-	186.05365	138.6
[M]+	165.07843	135.9
[M]-	165.07953	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe