CID 5466580

Pent-3-en-1-amine hydrochloride

Structural Information

Molecular Formula

C₅H₁₁N

SMILES

C/C=C/CCN

InChI

InChI=1S/C5H11N/c1-2-3-4-5-6/h2-3H,4-6H2,1H3/b3-2+

InChIKey

VWJYDONMXDIHNY-NSCUHMNNSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 41
Patents: 85.08915 Da
Monoisotopic Mass: 0.6
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]+	86.096426	116.8
[M+Na]+	108.07837	127.1
[M+NH4]+	103.12297	125.5
[M+K]+	124.05231	120.9
[M-H]-	84.081874	117.4
[M+Na-2H]-	106.06382	121.4
[M]+	85.088601	118.2
[M]-	85.089699	118.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe