CID 64294

1-adamantanesulfamoyl azide

Structural Information

Molecular Formula

C₁₀H₁₆N₄O₂S

SMILES

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)N=[N+]=[N-]

InChI

InChI=1S/C10H16N4O2S/c11-13-14-17(15,16)12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,12H,1-6H2

InChIKey

RQCOUDGAKFIKNK-UHFFFAOYSA-N

Compound name

1-(azidosulfonylamino)adamantane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 256.0994 Da
Monoisotopic Mass: 3.8
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]+	257.10668	140.4
[M+Na]+	279.08862	141.0
[M-H]-	255.09212	136.9
[M+NH4]+	274.13322	163.5
[M+K]+	295.06256	135.7
[M+H-H2O]+	239.09666	139.5
[M+HCOO]-	301.09760	150.1
[M+CH3COO]-	315.11325	202.7
[M+Na-2H]-	277.07407	159.3
[M]+	256.09885	140.5
[M]-	256.09995	140.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe