CID 120197

302-48-7

Structural Information

Molecular Formula

C₆H₁₄N₃OP

SMILES

CCNP(=O)(N1CC1)N2CC2

InChI

InChI=1S/C6H14N3OP/c1-2-7-11(10,8-3-4-8)9-5-6-9/h2-6H2,1H3,(H,7,10)

InChIKey

GQIJAAHMCTVDJP-UHFFFAOYSA-N

Compound name

N-[bis(aziridin-1-yl)phosphoryl]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 175.08745 Da
Monoisotopic Mass: -0.5
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]+	176.09473	160.7
[M+Na]+	198.07667	167.9
[M-H]-	174.08017	164.2
[M+NH4]+	193.12127	167.4
[M+K]+	214.05061	165.4
[M+H-H2O]+	158.08471	151.7
[M+HCOO]-	220.08565	183.7
[M+CH3COO]-	234.10130	195.1
[M+Na-2H]-	196.06212	162.3
[M]+	175.08690	164.3
[M]-	175.08800	164.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe