CID 134568

Ent 6249a

Structural Information

Molecular Formula

C₆H₁₄N₃PS

SMILES

CN(C)P(=S)(N1CC1)N2CC2

InChI

InChI=1S/C6H14N3PS/c1-7(2)10(11,8-3-4-8)9-5-6-9/h3-6H2,1-2H3

InChIKey

IXOXBOSWSMBIRQ-UHFFFAOYSA-N

Compound name

N-[bis(aziridin-1-yl)phosphinothioyl]-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 191.0646 Da
Monoisotopic Mass: 1.3
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]+	192.07188	126.8
[M+Na]+	214.05382	137.2
[M+NH4]+	209.09842	134.7
[M+K]+	230.02776	135.7
[M-H]-	190.05732	139.6
[M+Na-2H]-	212.03927	136.6
[M]+	191.06405	134.0
[M]-	191.06515	134.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.