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]+ 195.12538 143.2
[M+Na]+ 217.10732 150.3
[M-H]- 193.11082 149.9
[M+NH4]+ 212.15192 158.5
[M+K]+ 233.08126 144.6
[M+H-H2O]+ 177.11536 138.5
[M+HCOO]- 239.11630 161.4
[M+CH3COO]- 253.13195 175.1
[M+Na-2H]- 215.09277 152.3
[M]+ 194.11755 140.3
[M]- 194.11865 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.