CID 5382783

2-butene, 1,1,4,4-tetramethoxy-

Structural Information

Molecular Formula
C8H16O4
SMILES
COC(/C=C\C(OC)OC)OC
InChI
InChI=1S/C8H16O4/c1-9-7(10-2)5-6-8(11-3)12-4/h5-8H,1-4H3/b6-5-
InChIKey
ZFGVCDSFRAMNMT-WAYWQWQTSA-N
Compound name
(Z)-1,1,4,4-tetramethoxybut-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

101
Patents

176.10486 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.112136 138.9
[M+Na]+ 199.094078 145.2
[M-H]- 175.097584 139.0
[M+NH4]+ 194.138683 159.2
[M+K]+ 215.068018 146.7
[M+H-H2O]+ 159.102120 133.8
[M+HCOO]- 221.103061 161.3
[M+CH3COO]- 235.118711 181.3
[M+Na-2H]- 197.079526 142.5
[M]+ 176.10431142 144.8
[M]- 176.10540858 144.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe