CID 96836

Phosphine oxide, bis(1-aziridinyl)diallylamino-

Structural Information

Molecular Formula

C₁₀H₁₈N₃OP

SMILES

C=CCN(CC=C)P(=O)(N1CC1)N2CC2

InChI

InChI=1S/C10H18N3OP/c1-3-5-11(6-4-2)15(14,12-7-8-12)13-9-10-13/h3-4H,1-2,5-10H2

InChIKey

SRMNABONKJHKFQ-UHFFFAOYSA-N

Compound name

N-[bis(aziridin-1-yl)phosphoryl]-N-prop-2-enylprop-2-en-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3
Patents: 227.11874 Da
Monoisotopic Mass: 0.9
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]+	228.12602	134.9
[M+Na]+	250.10796	144.9
[M+NH4]+	245.15256	141.2
[M+K]+	266.08190	144.5
[M-H]-	226.11146	146.8
[M+Na-2H]-	248.09341	144.2
[M]+	227.11819	141.2
[M]-	227.11929	141.2

Literature stripe

literature stripe

Patent stripe

patents stripe