CID 82502370

1-(aminomethyl)cyclobutane-1-carbonitrile

Structural Information

Molecular Formula
C6H10N2
SMILES
C1CC(C1)(CN)C#N
InChI
InChI=1S/C6H10N2/c7-4-6(5-8)2-1-3-6/h1-4,7H2
InChIKey
UEBWHAAQVVWZAU-UHFFFAOYSA-N
Compound name
1-(aminomethyl)cyclobutane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

110.0844 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.091676 120.4
[M+Na]+ 133.073618 127.9
[M-H]- 109.077124 123.9
[M+NH4]+ 128.118223 136.5
[M+K]+ 149.047558 130.3
[M+H-H2O]+ 93.081660 105.6
[M+HCOO]- 155.082601 139.6
[M+CH3COO]- 169.098251 186.6
[M+Na-2H]- 131.059066 127.4
[M]+ 110.08385142 120.8
[M]- 110.08494858 120.8
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