CID 130149573

2-[3-(hydroxymethyl)oxolan-3-yl]ethan-1-ol

Structural Information

Molecular Formula
C7H14O3
SMILES
C1COCC1(CCO)CO
InChI
InChI=1S/C7H14O3/c8-3-1-7(5-9)2-4-10-6-7/h8-9H,1-6H2
InChIKey
CZMYAILSMFJUON-UHFFFAOYSA-N
Compound name
2-[3-(hydroxymethyl)oxolan-3-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.0943 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.101576 130.6
[M+Na]+ 169.083518 136.7
[M-H]- 145.087024 131.7
[M+NH4]+ 164.128123 152.8
[M+K]+ 185.057458 136.5
[M+H-H2O]+ 129.091560 126.8
[M+HCOO]- 191.092501 150.3
[M+CH3COO]- 205.108151 166.4
[M+Na-2H]- 167.068966 136.9
[M]+ 146.09375142 129.1
[M]- 146.09484858 129.1
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.