CID 82597389

2580207-72-1

Structural Information

Molecular Formula

C₈H₁₃N₃O

SMILES

C1COCC2=NC=C(N21)CCN

InChI

InChI=1S/C8H13N3O/c9-2-1-7-5-10-8-6-12-4-3-11(7)8/h5H,1-4,6,9H2

InChIKey

NVOWYHFTPBVXPW-UHFFFAOYSA-N

Compound name

2-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-yl)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 167.10587 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]+	168.113146	134.6
[M+Na]+	190.095088	142.0
[M-H]-	166.098594	136.2
[M+NH4]+	185.139693	153.5
[M+K]+	206.069028	140.9
[M+H-H2O]+	150.103130	127.3
[M+HCOO]-	212.104071	154.4
[M+CH3COO]-	226.119721	147.3
[M+Na-2H]-	188.080536	141.3
[M]+	167.10532142	132.6
[M]-	167.10641858	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.