CID 155943360

1-(4-cyclopropyl-1,2,3-thiadiazol-5-yl)ethan-1-ol

Structural Information

Molecular Formula
C7H10N2OS
SMILES
CC(C1=C(N=NS1)C2CC2)O
InChI
InChI=1S/C7H10N2OS/c1-4(10)7-6(5-2-3-5)8-9-11-7/h4-5,10H,2-3H2,1H3
InChIKey
IODINCCVXBGRQL-UHFFFAOYSA-N
Compound name
1-(4-cyclopropylthiadiazol-5-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.05139 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.058666 133.9
[M+Na]+ 193.040608 144.5
[M-H]- 169.044114 138.0
[M+NH4]+ 188.085213 148.7
[M+K]+ 209.014548 140.9
[M+H-H2O]+ 153.048650 127.1
[M+HCOO]- 215.049591 150.5
[M+CH3COO]- 229.065241 178.1
[M+Na-2H]- 191.026056 135.3
[M]+ 170.05084142 137.4
[M]- 170.05193858 137.4
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.