CID 4713099

Cyclopropanethiol

Structural Information

Molecular Formula
C3H6S
SMILES
C1CC1S
InChI
InChI=1S/C3H6S/c4-3-1-2-3/h3-4H,1-2H2
InChIKey
NQUFBBVYXNYYDX-UHFFFAOYSA-N
Compound name
cyclopropanethiol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2833
Patents

74.01902 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 75.026296 112.5
[M+Na]+ 97.008238 125.4
[M+NH4]+ 92.052843 123.5
[M+K]+ 112.98218 119.1
[M-H]- 73.011744 121.5
[M+Na-2H]- 94.993686 121.0
[M]+ 74.018471 118.4
[M]- 74.019569 118.4
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