CID 19938783

(4-(methoxymethyl)cyclohexyl)methanol

Structural Information

Molecular Formula
C9H18O2
SMILES
COCC1CCC(CC1)CO
InChI
InChI=1S/C9H18O2/c1-11-7-9-4-2-8(6-10)3-5-9/h8-10H,2-7H2,1H3
InChIKey
KSIFEWSPJQDERU-UHFFFAOYSA-N
Compound name
[4-(methoxymethyl)cyclohexyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

117
Patents

158.13068 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.13796 135.6
[M+Na]+ 181.11990 145.7
[M+NH4]+ 176.16450 144.2
[M+K]+ 197.09384 139.7
[M-H]- 157.12340 137.0
[M+Na-2H]- 179.10535 139.9
[M]+ 158.13013 137.2
[M]- 158.13123 137.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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Patent stripe

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