CID 222285

Erythritol

Structural Information

Molecular Formula

C₄H₁₀O₄

SMILES

C([C@H]([C@H](CO)O)O)O

InChI

InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2/t3-,4+

InChIKey

UNXHWFMMPAWVPI-ZXZARUISSA-N

Compound name

(2S,3R)-butane-1,2,3,4-tetrol

Related CIDs

2D Structure

compound 2d structure

10
Annotation Hits: 1611
References: 106235
Patents: 122.05791 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]+	123.06519	125.1
[M+Na]+	145.04713	130.8
[M-H]-	121.05063	120.0
[M+NH4]+	140.09173	144.4
[M+K]+	161.02107	130.2
[M+H-H2O]+	105.05517	121.2
[M+HCOO]-	167.05611	142.3
[M+CH3COO]-	181.07176	160.6
[M+Na-2H]-	143.03258	128.3
[M]+	122.05736	122.3
[M]-	122.05846	122.3

Literature stripe

literature stripe

Patent stripe

patents stripe