CID 93278

Diazo y

Structural Information

Molecular Formula

C₁₁H₁₄N₃

SMILES

CC1=C(C=CC(=C1)[N+]#N)N2CCCC2

InChI

InChI=1S/C11H14N3/c1-9-8-10(13-12)4-5-11(9)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3/q+1

InChIKey

ADOGRHNJEKVFAC-UHFFFAOYSA-N

Compound name

3-methyl-4-pyrrolidin-1-ylbenzenediazonium

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 78
Patents: 188.11877 Da
Monoisotopic Mass: 3.6
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]+	189.12605	143.5
[M+Na]+	211.10799	152.8
[M-H]-	187.11149	148.9
[M+NH4]+	206.15259	161.4
[M+K]+	227.08193	144.0
[M+H-H2O]+	171.11603	131.5
[M+HCOO]-	233.11697	163.7
[M+CH3COO]-	247.13262	192.9
[M+Na-2H]-	209.09344	149.6
[M]+	188.11822	135.6
[M]-	188.11932	135.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe