CID 23130223

98978-49-5

Structural Information

Molecular Formula

C₁₁H₁₁NO

SMILES

C1=CC=C2C(=C1)C=CC=C2CNO

InChI

InChI=1S/C11H11NO/c13-12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7,12-13H,8H2

InChIKey

MPCXCHXFWBBRME-UHFFFAOYSA-N

Compound name

N-(naphthalen-1-ylmethyl)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 173.08406 Da
Monoisotopic Mass: 2.2
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]+	174.09134	133.6
[M+Na]+	196.07328	141.3
[M-H]-	172.07678	137.0
[M+NH4]+	191.11788	154.1
[M+K]+	212.04722	137.6
[M+H-H2O]+	156.08132	127.7
[M+HCOO]-	218.08226	157.3
[M+CH3COO]-	232.09791	180.2
[M+Na-2H]-	194.05873	143.4
[M]+	173.08351	132.3
[M]-	173.08461	132.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe