CID 15741338

(2z)-3-bromoprop-2-enenitrile

Structural Information

Molecular Formula
C3H2BrN
SMILES
C(=C\Br)\C#N
InChI
InChI=1S/C3H2BrN/c4-2-1-3-5/h1-2H/b2-1-
InChIKey
PCNPNEFEZSKSEK-UPHRSURJSA-N
Compound name
(Z)-3-bromoprop-2-enenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

130.93706 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.94434 119.9
[M+Na]+ 153.92628 123.1
[M+NH4]+ 148.97088 122.5
[M+K]+ 169.90022 120.1
[M-H]- 129.92978 113.1
[M+Na-2H]- 151.91173 120.8
[M]+ 130.93651 116.6
[M]- 130.93761 116.6
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