CID 70193

918-47-8

Structural Information

Molecular Formula

C₄H₁₂FN₂PS

SMILES

CN(C)P(=S)(N(C)C)F

InChI

InChI=1S/C4H12FN2PS/c1-6(2)8(5,9)7(3)4/h1-4H3

InChIKey

SXQXNXHZZIROMZ-UHFFFAOYSA-N

Compound name

N-[dimethylamino(fluoro)phosphinothioyl]-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 170.04428 Da
Monoisotopic Mass: 2.1
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]+	171.05156	132.3
[M+Na]+	193.03350	139.0
[M-H]-	169.03700	133.4
[M+NH4]+	188.07810	154.5
[M+K]+	209.00744	140.0
[M+H-H2O]+	153.04154	123.5
[M+HCOO]-	215.04248	157.0
[M+CH3COO]-	229.05813	190.7
[M+Na-2H]-	191.01895	132.6
[M]+	170.04373	134.8
[M]-	170.04483	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.