CID 98161

2-ethoxy-4-methyl-3,4-dihydro-2h-pyran

Structural Information

Molecular Formula
C8H14O2
SMILES
CCOC1CC(C=CO1)C
InChI
InChI=1S/C8H14O2/c1-3-9-8-6-7(2)4-5-10-8/h4-5,7-8H,3,6H2,1-2H3
InChIKey
FYICJILYYFSSLQ-UHFFFAOYSA-N
Compound name
2-ethoxy-4-methyl-3,4-dihydro-2H-pyran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

142.09938 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.10666 128.7
[M+Na]+ 165.08860 135.4
[M-H]- 141.09210 132.8
[M+NH4]+ 160.13320 149.2
[M+K]+ 181.06254 136.3
[M+H-H2O]+ 125.09664 123.4
[M+HCOO]- 187.09758 150.3
[M+CH3COO]- 201.11323 174.1
[M+Na-2H]- 163.07405 135.9
[M]+ 142.09883 129.3
[M]- 142.09993 129.3
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

patents stripe