CID 18446289

643083-59-4

Structural Information

Molecular Formula
C7H10O
SMILES
C#CCOCC1CC1
InChI
InChI=1S/C7H10O/c1-2-5-8-6-7-3-4-7/h1,7H,3-6H2
InChIKey
DGDGVCYDMANHKF-UHFFFAOYSA-N
Compound name
prop-2-ynoxymethylcyclopropane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

110.073166 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.080442 117.2
[M+Na]+ 133.062384 132.6
[M-H]- 109.065890 122.7
[M+NH4]+ 128.106989 135.2
[M+K]+ 149.036324 127.5
[M+H-H2O]+ 93.070426 108.6
[M+HCOO]- 155.071367 137.7
[M+CH3COO]- 169.087017 181.9
[M+Na-2H]- 131.047832 125.8
[M]+ 110.07261742 117.3
[M]- 110.07371458 117.3
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