CID 547114

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

Structural Information

Molecular Formula
C7H12O2
SMILES
CC1CC(OC=C1)OC
InChI
InChI=1S/C7H12O2/c1-6-3-4-9-7(5-6)8-2/h3-4,6-7H,5H2,1-2H3
InChIKey
JVTCUFUKBFIIBA-UHFFFAOYSA-N
Compound name
2-methoxy-4-methyl-3,4-dihydro-2H-pyran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

128.08372 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.09100 124.1
[M+Na]+ 151.07294 136.5
[M+NH4]+ 146.11754 133.4
[M+K]+ 167.04688 130.9
[M-H]- 127.07644 127.7
[M+Na-2H]- 149.05839 130.2
[M]+ 128.08317 126.9
[M]- 128.08427 126.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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