CID 11116363

(e)-5-phenylpent-2-en-1-ol

Structural Information

Molecular Formula

C₁₁H₁₄O

SMILES

C1=CC=C(C=C1)CC/C=C/CO

InChI

InChI=1S/C11H14O/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1-4,6-8,12H,5,9-10H2/b6-2+

InChIKey

SJQRNJJCRWREAV-QHHAFSJGSA-N

Compound name

(E)-5-phenylpent-2-en-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 92
Patents: 162.10446 Da
Monoisotopic Mass: 2.3
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]+	163.11174	136.5
[M+Na]+	185.09368	149.2
[M+NH4]+	180.13828	145.3
[M+K]+	201.06762	141.3
[M-H]-	161.09718	138.6
[M+Na-2H]-	183.07913	143.7
[M]+	162.10391	138.9
[M]-	162.10501	138.9

Literature stripe

literature stripe

Patent stripe

patents stripe