CID 139692372

2296417-42-8

Structural Information

Molecular Formula
C8H10OS
SMILES
C1CC1C2=C(SC=C2)CO
InChI
InChI=1S/C8H10OS/c9-5-8-7(3-4-10-8)6-1-2-6/h3-4,6,9H,1-2,5H2
InChIKey
YDCWIEKKJKFHBX-UHFFFAOYSA-N
Compound name
(3-cyclopropylthiophen-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.04524 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.05252 133.4
[M+Na]+ 177.03446 145.9
[M+NH4]+ 172.07906 143.7
[M+K]+ 193.00840 140.8
[M-H]- 153.03796 143.2
[M+Na-2H]- 175.01991 141.7
[M]+ 154.04469 139.4
[M]- 154.04579 139.4
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.