CID 6991950

4-(methylamino)tetrahydro-2h-pyran

Structural Information

Molecular Formula
C6H13NO
SMILES
CNC1CCOCC1
InChI
InChI=1S/C6H13NO/c1-7-6-2-4-8-5-3-6/h6-7H,2-5H2,1H3
InChIKey
WGYZZCUTSHNMET-UHFFFAOYSA-N
Compound name
N-methyloxan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1859
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 123.3
[M+Na]+ 138.08894 128.0
[M-H]- 114.09244 126.8
[M+NH4]+ 133.13354 144.0
[M+K]+ 154.06288 128.9
[M+H-H2O]+ 98.096980 117.7
[M+HCOO]- 160.09792 144.8
[M+CH3COO]- 174.11357 170.0
[M+Na-2H]- 136.07439 131.4
[M]+ 115.09917 119.0
[M]- 115.10027 119.0
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