CID 130929238

306934-53-2

Structural Information

Molecular Formula
C8H14O
SMILES
C1CC1[C@H]2C[C@@H]2CCO
InChI
InChI=1S/C8H14O/c9-4-3-7-5-8(7)6-1-2-6/h6-9H,1-5H2/t7-,8+/m0/s1
InChIKey
AEHUKHLOHKICDC-JGVFFNPUSA-N
Compound name
2-[(1R,2R)-2-cyclopropylcyclopropyl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

126.10446 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.111736 134.8
[M+Na]+ 149.093678 142.5
[M-H]- 125.097184 141.1
[M+NH4]+ 144.138283 145.1
[M+K]+ 165.067618 140.8
[M+H-H2O]+ 109.101720 129.3
[M+HCOO]- 171.102661 154.5
[M+CH3COO]- 185.118311 185.1
[M+Na-2H]- 147.079126 138.8
[M]+ 126.10391142 137.9
[M]- 126.10500858 137.9
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

No patent data available for this compound.