CID 3019909

Qfzuhqawvlndnb-uhfffaoysa-n

Structural Information

Molecular Formula

C₁₃H₂₁NO

SMILES

CC(=CCCC1=CCCC(C1)C=NO)C

InChI

InChI=1S/C13H21NO/c1-11(2)5-3-6-12-7-4-8-13(9-12)10-14-15/h5,7,10,13,15H,3-4,6,8-9H2,1-2H3

InChIKey

QFZUHQAWVLNDNB-UHFFFAOYSA-N

Compound name

N-[[3-(4-methylpent-3-enyl)cyclohex-3-en-1-yl]methylidene]hydroxylamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 207.16231 Da
Monoisotopic Mass: 3.2
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]+	208.169586	150.9
[M+Na]+	230.151528	155.1
[M-H]-	206.155034	153.5
[M+NH4]+	225.196133	169.6
[M+K]+	246.125468	152.4
[M+H-H2O]+	190.159570	144.6
[M+HCOO]-	252.160511	171.9
[M+CH3COO]-	266.176161	189.9
[M+Na-2H]-	228.136976	153.3
[M]+	207.16176142	148.2
[M]-	207.16285858	148.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.