CID 114644

Citral oxime

Structural Information

Molecular Formula

C₁₀H₁₇NO

SMILES

CC(=CCCC(=CC=NO)C)C

InChI

InChI=1S/C10H17NO/c1-9(2)5-4-6-10(3)7-8-11-12/h5,7-8,12H,4,6H2,1-3H3

InChIKey

LXFKDMGMYAHNAQ-UHFFFAOYSA-N

Compound name

N-(3,7-dimethylocta-2,6-dienylidene)hydroxylamine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 60
Patents: 167.13101 Da
Monoisotopic Mass: 3.3
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]+	168.13829	142.0
[M+Na]+	190.12023	150.5
[M+NH4]+	185.16483	148.6
[M+K]+	206.09417	144.8
[M-H]-	166.12373	141.0
[M+Na-2H]-	188.10568	144.2
[M]+	167.13046	142.5
[M]-	167.13156	142.5

Literature stripe

literature stripe

Patent stripe

patents stripe