CID 231999

N-phenylbenzimidoyl cyanide

Structural Information

Molecular Formula
C14H10N2
SMILES
C1=CC=C(C=C1)C(=NC2=CC=CC=C2)C#N
InChI
InChI=1S/C14H10N2/c15-11-14(12-7-3-1-4-8-12)16-13-9-5-2-6-10-13/h1-10H
InChIKey
NPUCOHNCJJHBCA-UHFFFAOYSA-N
Compound name
N-phenylbenzenecarboximidoyl cyanide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

7
Patents

206.0844 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.09168 151.8
[M+Na]+ 229.07362 160.7
[M-H]- 205.07712 157.9
[M+NH4]+ 224.11822 168.4
[M+K]+ 245.04756 155.1
[M+H-H2O]+ 189.08166 137.5
[M+HCOO]- 251.08260 173.7
[M+CH3COO]- 265.09825 201.4
[M+Na-2H]- 227.05907 158.1
[M]+ 206.08385 145.3
[M]- 206.08495 145.3
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

No patent data available for this compound.