CID 34742

2-methyloxolan-3-ol

Structural Information

Molecular Formula
C5H10O2
SMILES
CC1C(CCO1)O
InChI
InChI=1S/C5H10O2/c1-4-5(6)2-3-7-4/h4-6H,2-3H2,1H3
InChIKey
ZFVWBUVYNPLIIS-UHFFFAOYSA-N
Compound name
2-methyloxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

316
Patents

102.06808 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.075356 118.0
[M+Na]+ 125.057298 125.4
[M-H]- 101.060804 120.9
[M+NH4]+ 120.101903 141.1
[M+K]+ 141.031238 126.2
[M+H-H2O]+ 85.065340 113.9
[M+HCOO]- 147.066281 139.6
[M+CH3COO]- 161.081931 162.4
[M+Na-2H]- 123.042746 124.0
[M]+ 102.06753142 116.2
[M]- 102.06862858 116.2
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