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

17
Patents

182.0844 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09168 144.8
[M+Na]+ 205.07362 154.8
[M-H]- 181.07712 148.1
[M+NH4]+ 200.11822 163.1
[M+K]+ 221.04756 149.1
[M+H-H2O]+ 165.08166 132.4
[M+HCOO]- 227.08260 164.0
[M+CH3COO]- 241.09825 156.2
[M+Na-2H]- 203.05907 151.0
[M]+ 182.08385 137.6
[M]- 182.08495 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