CID 3057991

74332-96-0

Structural Information

Molecular Formula
C11H16NO2
SMILES
CC1=CC(=[N+]2CCOCC2)C=C(O1)C
InChI
InChI=1S/C11H16NO2/c1-9-7-11(8-10(2)14-9)12-3-5-13-6-4-12/h7-8H,3-6H2,1-2H3/q+1
InChIKey
QFWZCXJEIAMHOL-UHFFFAOYSA-N
Compound name
4-(2,6-dimethylpyran-4-ylidene)morpholin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.1181 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.125376 143.2
[M+Na]+ 217.107318 150.3
[M-H]- 193.110824 149.9
[M+NH4]+ 212.151923 158.5
[M+K]+ 233.081258 144.6
[M+H-H2O]+ 177.115360 138.5
[M+HCOO]- 239.116301 161.4
[M+CH3COO]- 253.131951 175.1
[M+Na-2H]- 215.092766 152.3
[M]+ 194.11755142 140.3
[M]- 194.11864858 140.3
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

No patent data available for this compound.