CID 12187971

15135-98-5

Structural Information

Molecular Formula
C6H10O
SMILES
C=C[C@@H]1C[C@H]1CO
InChI
InChI=1S/C6H10O/c1-2-5-3-6(5)4-7/h2,5-7H,1,3-4H2/t5-,6+/m1/s1
InChIKey
BBEUBSMPIQDNHL-RITPCOANSA-N
Compound name
[(1R,2S)-2-ethenylcyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

98.073166 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.080442 118.1
[M+Na]+ 121.062384 128.1
[M-H]- 97.065890 121.9
[M+NH4]+ 116.106989 136.3
[M+K]+ 137.036324 125.6
[M+H-H2O]+ 81.070426 113.2
[M+HCOO]- 143.071367 141.2
[M+CH3COO]- 157.087017 169.1
[M+Na-2H]- 119.047832 124.8
[M]+ 98.07261742 119.8
[M]- 98.07371458 119.8
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