CID 22636790

[1-(methoxymethyl)cyclopropyl]methanol

Structural Information

Molecular Formula
C6H12O2
SMILES
COCC1(CC1)CO
InChI
InChI=1S/C6H12O2/c1-8-5-6(4-7)2-3-6/h7H,2-5H2,1H3
InChIKey
WGLFLXUUQCEVBP-UHFFFAOYSA-N
Compound name
[1-(methoxymethyl)cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

84
Patents

116.08373 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.091006 124.2
[M+Na]+ 139.072948 133.7
[M-H]- 115.076454 128.0
[M+NH4]+ 134.117553 143.4
[M+K]+ 155.046888 133.1
[M+H-H2O]+ 99.080990 120.1
[M+HCOO]- 161.081931 147.0
[M+CH3COO]- 175.097581 170.4
[M+Na-2H]- 137.058396 132.5
[M]+ 116.08318142 128.2
[M]- 116.08427858 128.2
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