CID 87101

17409-52-8

Structural Information

Molecular Formula

C₁₀H₁₂N₃O

SMILES

C1COCCN1C2=CC=C(C=C2)[N+]#N

InChI

InChI=1S/C10H12N3O/c11-12-9-1-3-10(4-2-9)13-5-7-14-8-6-13/h1-4H,5-8H2/q+1

InChIKey

NJYDJNRTEZIUBS-UHFFFAOYSA-N

Compound name

4-morpholin-4-ylbenzenediazonium

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 268
Patents: 190.09804 Da
Monoisotopic Mass: 2.0
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]+	191.10532	140.3
[M+Na]+	213.08726	148.3
[M-H]-	189.09076	145.6
[M+NH4]+	208.13186	154.9
[M+K]+	229.06120	141.2
[M+H-H2O]+	173.09530	127.9
[M+HCOO]-	235.09624	158.2
[M+CH3COO]-	249.11189	191.4
[M+Na-2H]-	211.07271	149.7
[M]+	190.09749	131.6
[M]-	190.09859	131.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe