CID 15047052

1-cyclohexylcyclopropan-1-ol

Structural Information

Molecular Formula
C9H16O
SMILES
C1CCC(CC1)C2(CC2)O
InChI
InChI=1S/C9H16O/c10-9(6-7-9)8-4-2-1-3-5-8/h8,10H,1-7H2
InChIKey
AOLOKLDPBPVGSF-UHFFFAOYSA-N
Compound name
1-cyclohexylcyclopropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

140.12012 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.12740 131.0
[M+Na]+ 163.10934 137.6
[M-H]- 139.11284 136.7
[M+NH4]+ 158.15394 148.6
[M+K]+ 179.08328 136.4
[M+H-H2O]+ 123.11738 125.8
[M+HCOO]- 185.11832 150.2
[M+CH3COO]- 199.13397 173.7
[M+Na-2H]- 161.09479 137.3
[M]+ 140.11957 127.9
[M]- 140.12067 127.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe