CID 10012053

(e)-4-(dimethylamino)but-2-enoyl chloride

Structural Information

Molecular Formula

C₆H₁₀ClNO

SMILES

CN(C)C/C=C/C(=O)Cl

InChI

InChI=1S/C6H10ClNO/c1-8(2)5-3-4-6(7)9/h3-4H,5H2,1-2H3/b4-3+

InChIKey

BOTUQNGRMXZOTH-ONEGZZNKSA-N

Compound name

(E)-4-(dimethylamino)but-2-enoyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 475
Patents: 147.04509 Da
Monoisotopic Mass: 1.1
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]+	148.05237	129.0
[M+Na]+	170.03431	139.6
[M+NH4]+	165.07891	137.2
[M+K]+	186.00825	133.9
[M-H]-	146.03781	129.0
[M+Na-2H]-	168.01976	133.2
[M]+	147.04454	130.5
[M]-	147.04564	130.5

Literature stripe

literature stripe

Patent stripe

patents stripe