CID 60976

Metepa

Structural Information

Molecular Formula

C₉H₁₈N₃OP

SMILES

CC1CN1P(=O)(N2CC2C)N3CC3C

InChI

InChI=1S/C9H18N3OP/c1-7-4-10(7)14(13,11-5-8(11)2)12-6-9(12)3/h7-9H,4-6H2,1-3H3

InChIKey

AVUYXHYHTTVPRX-UHFFFAOYSA-N

Compound name

1-bis(2-methylaziridin-1-yl)phosphoryl-2-methylaziridine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 6
References: 3810
Patents: 215.11874 Da
Monoisotopic Mass: 0.7
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]+	216.12602	108.8
[M+Na]+	238.10796	118.9
[M+NH4]+	233.15256	114.9
[M+K]+	254.08190	121.7
[M-H]-	214.11146	122.9
[M+Na-2H]-	236.09341	120.5
[M]+	215.11819	116.3
[M]-	215.11929	116.3

Literature stripe

literature stripe

Patent stripe

patents stripe