CID 57578793

(1-methanesulfonylcyclopropyl)methanol

Structural Information

Molecular Formula
C5H10O3S
SMILES
CS(=O)(=O)C1(CC1)CO
InChI
InChI=1S/C5H10O3S/c1-9(7,8)5(4-6)2-3-5/h6H,2-4H2,1H3
InChIKey
DZHVIHLGSPFPGN-UHFFFAOYSA-N
Compound name
(1-methylsulfonylcyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

150.03506 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.042336 127.2
[M+Na]+ 173.024278 137.3
[M-H]- 149.027784 131.0
[M+NH4]+ 168.068883 145.2
[M+K]+ 188.998218 135.5
[M+H-H2O]+ 133.032320 123.5
[M+HCOO]- 195.033261 143.9
[M+CH3COO]- 209.048911 171.8
[M+Na-2H]- 171.009726 133.6
[M]+ 150.03451142 132.4
[M]- 150.03560858 132.4
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

patents stripe