CID 16770335

2-amino-2,2-dicyclopropylacetonitrile

Structural Information

Molecular Formula
C8H12N2
SMILES
C1CC1C(C#N)(C2CC2)N
InChI
InChI=1S/C8H12N2/c9-5-8(10,6-1-2-6)7-3-4-7/h6-7H,1-4,10H2
InChIKey
ZGBIWUWHJXWUNS-UHFFFAOYSA-N
Compound name
2-amino-2,2-dicyclopropylacetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

136.10005 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 132.5
[M+Na]+ 159.08927 148.4
[M-H]- 135.09277 142.0
[M+NH4]+ 154.13387 144.5
[M+K]+ 175.06321 141.8
[M+H-H2O]+ 119.09731 126.6
[M+HCOO]- 181.09825 152.6
[M+CH3COO]- 195.11390 200.0
[M+Na-2H]- 157.07472 140.2
[M]+ 136.09950 132.7
[M]- 136.10060 132.7
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