CID 284148

11-bromo-1-undecene

Structural Information

Molecular Formula

C₁₁H₂₁Br

SMILES

C=CCCCCCCCCCBr

InChI

InChI=1S/C11H21Br/c1-2-3-4-5-6-7-8-9-10-11-12/h2H,1,3-11H2

InChIKey

YPLVPFUSXYSHJD-UHFFFAOYSA-N

Compound name

11-bromoundec-1-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 983
Patents: 232.08266 Da
Monoisotopic Mass: 6.0
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]+	233.08994	150.9
[M+Na]+	255.07188	160.0
[M-H]-	231.07538	153.1
[M+NH4]+	250.11648	172.7
[M+K]+	271.04582	148.2
[M+H-H2O]+	215.07992	151.1
[M+HCOO]-	277.08086	170.8
[M+CH3COO]-	291.09651	191.6
[M+Na-2H]-	253.05733	156.4
[M]+	232.08211	171.6
[M]-	232.08321	171.6

Literature stripe

literature stripe

Patent stripe

patents stripe