CID 14265450

Diphenylmethyl selenocyanate

Structural Information

Molecular Formula
C14H11NSe
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)[Se]C#N
InChI
InChI=1S/C14H11NSe/c15-11-16-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H
InChIKey
RNAKAYCVSPMHHK-UHFFFAOYSA-N
Compound name
benzhydryl selenocyanate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

1
Patents

273.00568 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.01296 162.6
[M+Na]+ 295.99490 171.0
[M-H]- 271.99840 167.0
[M+NH4]+ 291.03950 178.4
[M+K]+ 311.96884 164.5
[M+H-H2O]+ 256.00294 148.3
[M+HCOO]- 318.00388 181.3
[M+CH3COO]- 332.01953 200.8
[M+Na-2H]- 293.98035 166.8
[M]+ 273.00513 156.2
[M]- 273.00623 156.2
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