CID 22042312

124573-09-7

Structural Information

Molecular Formula
C8H14O3
SMILES
CC1(OCCO1)C2(CC2)CO
InChI
InChI=1S/C8H14O3/c1-7(10-4-5-11-7)8(6-9)2-3-8/h9H,2-6H2,1H3
InChIKey
KUXYVHJHQMKRTQ-UHFFFAOYSA-N
Compound name
[1-(2-methyl-1,3-dioxolan-2-yl)cyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

158.0943 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.101576 130.1
[M+Na]+ 181.083518 138.9
[M-H]- 157.087024 137.8
[M+NH4]+ 176.128123 148.2
[M+K]+ 197.057458 141.2
[M+H-H2O]+ 141.091560 126.7
[M+HCOO]- 203.092501 149.3
[M+CH3COO]- 217.108151 174.3
[M+Na-2H]- 179.068966 139.1
[M]+ 158.09375142 133.6
[M]- 158.09484858 133.6
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