CID 4341744

3-methoxypiperidine

Structural Information

Molecular Formula
C6H13NO
SMILES
COC1CCCNC1
InChI
InChI=1S/C6H13NO/c1-8-6-3-2-4-7-5-6/h6-7H,2-5H2,1H3
InChIKey
MRWRHHSVHWCISU-UHFFFAOYSA-N
Compound name
3-methoxypiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1320
Patents

115.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 124.5
[M+Na]+ 138.08894 129.6
[M-H]- 114.09244 124.6
[M+NH4]+ 133.13354 144.9
[M+K]+ 154.06288 128.8
[M+H-H2O]+ 98.096980 118.7
[M+HCOO]- 160.09792 143.1
[M+CH3COO]- 174.11357 165.3
[M+Na-2H]- 136.07439 130.8
[M]+ 115.09917 119.1
[M]- 115.10027 119.1
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