CID 10486988

(3,3-dimethoxycyclobutyl)methanol

Structural Information

Molecular Formula
C7H14O3
SMILES
COC1(CC(C1)CO)OC
InChI
InChI=1S/C7H14O3/c1-9-7(10-2)3-6(4-7)5-8/h6,8H,3-5H2,1-2H3
InChIKey
PPZLOPBUFOFNKE-UHFFFAOYSA-N
Compound name
(3,3-dimethoxycyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

146.0943 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.101576 128.3
[M+Na]+ 169.083518 134.6
[M-H]- 145.087024 130.9
[M+NH4]+ 164.128123 144.7
[M+K]+ 185.057458 137.6
[M+H-H2O]+ 129.091560 120.0
[M+HCOO]- 191.092501 149.3
[M+CH3COO]- 205.108151 175.8
[M+Na-2H]- 167.068966 134.7
[M]+ 146.09375142 138.8
[M]- 146.09484858 138.8
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