CID 155943340

2-methyl-3,6-dihydro-2h-pyran-2-carbaldehyde

Structural Information

Molecular Formula
C7H10O2
SMILES
CC1(CC=CCO1)C=O
InChI
InChI=1S/C7H10O2/c1-7(6-8)4-2-3-5-9-7/h2-3,6H,4-5H2,1H3
InChIKey
PHQQMIKIFLPVPX-UHFFFAOYSA-N
Compound name
6-methyl-2,5-dihydropyran-6-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

126.06808 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.07536 122.3
[M+Na]+ 149.05730 129.8
[M-H]- 125.06080 126.7
[M+NH4]+ 144.10190 145.1
[M+K]+ 165.03124 130.6
[M+H-H2O]+ 109.06534 117.9
[M+HCOO]- 171.06628 144.5
[M+CH3COO]- 185.08193 168.6
[M+Na-2H]- 147.04275 132.0
[M]+ 126.06753 121.8
[M]- 126.06863 121.8
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.