CID 107980

Dimatif

Structural Information

Molecular Formula
C4H10N3PS
SMILES
C1CN1P(=S)(N)N2CC2
InChI
InChI=1S/C4H10N3PS/c5-8(9,6-1-2-6)7-3-4-7/h1-4H2,(H2,5,9)
InChIKey
RXZRAOONKFIKQQ-UHFFFAOYSA-N
Compound name
1-[amino(aziridin-1-yl)phosphinothioyl]aziridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

3241
Patents

163.03331 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04059 146.3
[M+Na]+ 186.02253 153.8
[M-H]- 162.02603 149.5
[M+NH4]+ 181.06713 153.6
[M+K]+ 201.99647 151.0
[M+H-H2O]+ 146.03057 137.3
[M+HCOO]- 208.03151 165.1
[M+CH3COO]- 222.04716 191.0
[M+Na-2H]- 184.00798 145.6
[M]+ 163.03276 148.6
[M]- 163.03386 148.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.