CID 121599156

[3-(methoxymethyl)oxolan-3-yl]methanol

Structural Information

Molecular Formula
C7H14O3
SMILES
COCC1(CCOC1)CO
InChI
InChI=1S/C7H14O3/c1-9-5-7(4-8)2-3-10-6-7/h8H,2-6H2,1H3
InChIKey
QYDPPBNXQSXAEF-UHFFFAOYSA-N
Compound name
[3-(methoxymethyl)oxolan-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.0943 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.101576 129.7
[M+Na]+ 169.083518 136.2
[M-H]- 145.087024 132.2
[M+NH4]+ 164.128123 152.7
[M+K]+ 185.057458 137.0
[M+H-H2O]+ 129.091560 125.7
[M+HCOO]- 191.092501 150.9
[M+CH3COO]- 205.108151 169.0
[M+Na-2H]- 167.068966 136.6
[M]+ 146.09375142 130.0
[M]- 146.09484858 130.0
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.