CID 93929

58066-96-9

Structural Information

Molecular Formula

C₁₁H₁₆N₂O₂

SMILES

CCN(CCO)C1=CC(=C(C=C1)N=O)C

InChI

InChI=1S/C11H16N2O2/c1-3-13(6-7-14)10-4-5-11(12-15)9(2)8-10/h4-5,8,14H,3,6-7H2,1-2H3

InChIKey

GORXOMQYBYURLM-UHFFFAOYSA-N

Compound name

2-(N-ethyl-3-methyl-4-nitrosoanilino)ethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 6
Patents: 208.12119 Da
Monoisotopic Mass: 1.5
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]+	209.12847	146.6
[M+Na]+	231.11041	157.6
[M+NH4]+	226.15501	154.3
[M+K]+	247.08435	151.7
[M-H]-	207.11391	149.5
[M+Na-2H]-	229.09586	152.9
[M]+	208.12064	148.8
[M]-	208.12174	148.8

Literature stripe

literature stripe

Patent stripe

patents stripe