CID 28279232

4-(dimethylamino)piperidine-4-carbonitrile

Structural Information

Molecular Formula
C8H15N3
SMILES
CN(C)C1(CCNCC1)C#N
InChI
InChI=1S/C8H15N3/c1-11(2)8(7-9)3-5-10-6-4-8/h10H,3-6H2,1-2H3
InChIKey
NOHFNNLNFGDGMP-UHFFFAOYSA-N
Compound name
4-(dimethylamino)piperidine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

153.1266 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.13388 133.3
[M+Na]+ 176.11582 140.2
[M-H]- 152.11932 134.7
[M+NH4]+ 171.16042 152.2
[M+K]+ 192.08976 138.3
[M+H-H2O]+ 136.12386 120.9
[M+HCOO]- 198.12480 149.4
[M+CH3COO]- 212.14045 191.1
[M+Na-2H]- 174.10127 139.1
[M]+ 153.12605 123.5
[M]- 153.12715 123.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe