CID 10534676

(2-methyl-3,6-dihydro-2h-pyran-2-yl)methanol

Structural Information

Molecular Formula
C7H12O2
SMILES
CC1(CC=CCO1)CO
InChI
InChI=1S/C7H12O2/c1-7(6-8)4-2-3-5-9-7/h2-3,8H,4-6H2,1H3
InChIKey
UETJYGNTHWAMGN-UHFFFAOYSA-N
Compound name
(6-methyl-2,5-dihydropyran-6-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

128.08372 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.09100 124.8
[M+Na]+ 151.07294 131.5
[M-H]- 127.07644 127.7
[M+NH4]+ 146.11754 146.9
[M+K]+ 167.04688 132.0
[M+H-H2O]+ 111.08098 120.6
[M+HCOO]- 173.08192 145.3
[M+CH3COO]- 187.09757 166.8
[M+Na-2H]- 149.05839 133.9
[M]+ 128.08317 123.1
[M]- 128.08427 123.1
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.