CID 13979506

(2e)-2,3-diiodoprop-2-en-1-ol

Structural Information

Molecular Formula
C3H4I2O
SMILES
C(/C(=C\I)/I)O
InChI
InChI=1S/C3H4I2O/c4-1-3(5)2-6/h1,6H,2H2/b3-1+
InChIKey
CYYOKOZRJLDIIJ-HNQUOIGGSA-N
Compound name
(E)-2,3-diiodoprop-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.83517 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.84245 130.3
[M+Na]+ 332.82439 123.5
[M-H]- 308.82789 118.9
[M+NH4]+ 327.86899 141.5
[M+K]+ 348.79833 134.4
[M+H-H2O]+ 292.83243 120.5
[M+HCOO]- 354.83337 141.3
[M+CH3COO]- 368.84902 189.3
[M+Na-2H]- 330.80984 118.2
[M]+ 309.83462 124.6
[M]- 309.83572 124.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.