CID 28717

2,6-dimethyl-1-nitrosopiperidine

Structural Information

Molecular Formula
C7H14N2O
SMILES
CC1CCCC(N1N=O)C
InChI
InChI=1S/C7H14N2O/c1-6-4-3-5-7(2)9(6)8-10/h6-7H,3-5H2,1-2H3
InChIKey
MDOIIQGEWWYGKD-UHFFFAOYSA-N
Compound name
2,6-dimethyl-1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

6
Patents

142.11061 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.11789 129.4
[M+Na]+ 165.09983 136.3
[M-H]- 141.10333 132.8
[M+NH4]+ 160.14443 150.3
[M+K]+ 181.07377 136.3
[M+H-H2O]+ 125.10787 123.0
[M+HCOO]- 187.10881 151.9
[M+CH3COO]- 201.12446 179.9
[M+Na-2H]- 163.08528 135.1
[M]+ 142.11006 127.4
[M]- 142.11116 127.4
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