CID 11651254

2-amino-2-(naphthalen-2-yl)acetonitrile

Structural Information

Molecular Formula
C12H10N2
SMILES
C1=CC=C2C=C(C=CC2=C1)C(C#N)N
InChI
InChI=1S/C12H10N2/c13-8-12(14)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12H,14H2
InChIKey
ZUHUNJFWSTWMJL-UHFFFAOYSA-N
Compound name
2-amino-2-naphthalen-2-ylacetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

182.0844 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.091676 144.8
[M+Na]+ 205.073618 154.8
[M-H]- 181.077124 148.1
[M+NH4]+ 200.118223 163.1
[M+K]+ 221.047558 149.1
[M+H-H2O]+ 165.081660 132.4
[M+HCOO]- 227.082601 164.0
[M+CH3COO]- 241.098251 156.2
[M+Na-2H]- 203.059066 151.0
[M]+ 182.08385142 137.6
[M]- 182.08494858 137.6
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