CID 555340

Phenyl selenocyanate

Structural Information

Molecular Formula
C7H5NSe
SMILES
C1=CC=C(C=C1)[Se]C#N
InChI
InChI=1S/C7H5NSe/c8-6-9-7-4-2-1-3-5-7/h1-5H
InChIKey
NODWRXQVQYOJGN-UHFFFAOYSA-N
Compound name
phenyl selenocyanate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

182.95872 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.96600 134.0
[M+Na]+ 205.94794 146.9
[M+NH4]+ 200.99254 140.0
[M+K]+ 221.92188 136.0
[M-H]- 181.95144 129.6
[M+Na-2H]- 203.93339 139.3
[M]+ 182.95817 133.8
[M]- 182.95927 133.8
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