CID 84640

14774-35-7

Structural Information

Molecular Formula
C6H10O2
SMILES
C1COCC(=C1)CO
InChI
InChI=1S/C6H10O2/c7-4-6-2-1-3-8-5-6/h2,7H,1,3-5H2
InChIKey
LIDHMZQWCDKALW-UHFFFAOYSA-N
Compound name
3,6-dihydro-2H-pyran-5-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

114.06808 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.07536 120.6
[M+Na]+ 137.05730 126.8
[M-H]- 113.06080 123.2
[M+NH4]+ 132.10190 141.1
[M+K]+ 153.03124 127.2
[M+H-H2O]+ 97.065340 115.7
[M+HCOO]- 159.06628 141.3
[M+CH3COO]- 173.08193 164.2
[M+Na-2H]- 135.04275 129.0
[M]+ 114.06753 118.2
[M]- 114.06863 118.2
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