CID 81076

2,4-dichloro-6-morpholino-1,3,5-triazine

Structural Information

Molecular Formula

C₇H₈Cl₂N₄O

SMILES

C1COCCN1C2=NC(=NC(=N2)Cl)Cl

InChI

InChI=1S/C7H8Cl2N4O/c8-5-10-6(9)12-7(11-5)13-1-3-14-4-2-13/h1-4H2

InChIKey

UQAMDAUJTXFNAD-UHFFFAOYSA-N

Compound name

4-(4,6-dichloro-1,3,5-triazin-2-yl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 9771
Patents: 234.00752 Da
Monoisotopic Mass: 2.0
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]+	235.01480	146.1
[M+Na]+	256.99674	161.6
[M+NH4]+	252.04134	153.9
[M+K]+	272.97068	154.7
[M-H]-	233.00024	149.1
[M+Na-2H]-	254.98219	153.5
[M]+	234.00697	149.7
[M]-	234.00807	149.7

Literature stripe

literature stripe

Patent stripe

patents stripe