CID 6374

Iodoform

Structural Information

Molecular Formula
CHI3
SMILES
C(I)(I)I
InChI
InChI=1S/CHI3/c2-1(3)4/h1H
InChIKey
OKJPEAGHQZHRQV-UHFFFAOYSA-N
Compound name
iodoform
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

322
References

17865
Patents

393.7212 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.728476 120.6
[M+Na]+ 416.710418 109.1
[M-H]- 392.713924 109.9
[M+NH4]+ 411.755023 127.2
[M+K]+ 432.684358 124.6
[M+H-H2O]+ 376.718460 110.7
[M+HCOO]- 438.719401 127.2
[M+CH3COO]- 452.735051 208.6
[M+Na-2H]- 414.695866 109.1
[M]+ 393.72065142 115.0
[M]- 393.72174858 115.0
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

patents stripe