CID 87623914

4-methoxy-1-nitrosopiperidine

Structural Information

Molecular Formula
C6H12N2O2
SMILES
COC1CCN(CC1)N=O
InChI
InChI=1S/C6H12N2O2/c1-10-6-2-4-8(7-9)5-3-6/h6H,2-5H2,1H3
InChIKey
SWUMSISCMUGLAL-UHFFFAOYSA-N
Compound name
4-methoxy-1-nitrosopiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

144.08987 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.097146 128.0
[M+Na]+ 167.079088 134.2
[M-H]- 143.082594 131.1
[M+NH4]+ 162.123693 148.4
[M+K]+ 183.053028 135.0
[M+H-H2O]+ 127.087130 121.2
[M+HCOO]- 189.088071 151.0
[M+CH3COO]- 203.103721 177.7
[M+Na-2H]- 165.064536 134.9
[M]+ 144.08932142 126.7
[M]- 144.09041858 126.7
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