CID 510370

3-penten-1-ol, (3e)-

Structural Information

Molecular Formula

C₅H₁₀O

SMILES

C/C=C/CCO

InChI

InChI=1S/C5H10O/c1-2-3-4-5-6/h2-3,6H,4-5H2,1H3/b3-2+

InChIKey

FSUXYWPILZJGCC-NSCUHMNNSA-N

Compound name

(E)-pent-3-en-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 3583
Patents: 86.073166 Da
Monoisotopic Mass: 0.9
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]+	87.080442	116.5
[M+Na]+	109.06238	124.1
[M-H]-	85.065890	115.7
[M+NH4]+	104.10699	139.9
[M+K]+	125.03632	123.2
[M+H-H2O]+	69.070426	112.8
[M+HCOO]-	131.07137	139.6
[M+CH3COO]-	145.08702	161.9
[M+Na-2H]-	107.04783	123.8
[M]+	86.072617	116.2
[M]-	86.073715	116.2

Literature stripe

literature stripe

Patent stripe

patents stripe