CID 214666

33581-92-9

Structural Information

Molecular Formula

C₂H₆N₄O₂S

SMILES

CN(C)S(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C2H6N4O2S/c1-6(2)9(7,8)5-4-3/h1-2H3

InChIKey

FGRVTXLFWSNQHV-UHFFFAOYSA-N

Compound name

[azidosulfonyl(methyl)amino]methane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 150.02115 Da
Monoisotopic Mass: 0.8
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]+	151.02843	122.7
[M+Na]+	173.01037	130.2
[M-H]-	149.01387	127.8
[M+NH4]+	168.05497	144.5
[M+K]+	188.98431	126.5
[M+H-H2O]+	133.01841	121.1
[M+HCOO]-	195.01935	149.4
[M+CH3COO]-	209.03500	179.2
[M+Na-2H]-	170.99582	132.5
[M]+	150.02060	122.9
[M]-	150.02170	122.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe