CID 75176212

1443291-21-1

Structural Information

Molecular Formula
C11H11Cl2N3O
SMILES
CC(C1=CN(N=N1)CC2=C(C=C(C=C2)Cl)Cl)O
InChI
InChI=1S/C11H11Cl2N3O/c1-7(17)11-6-16(15-14-11)5-8-2-3-9(12)4-10(8)13/h2-4,6-7,17H,5H2,1H3
InChIKey
BAFURGCWSQPPTI-UHFFFAOYSA-N
Compound name
1-[1-[(2,4-dichlorophenyl)methyl]triazol-4-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

271.02792 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.03520 156.7
[M+Na]+ 294.01714 171.5
[M+NH4]+ 289.06174 164.2
[M+K]+ 309.99108 166.1
[M-H]- 270.02064 158.1
[M+Na-2H]- 292.00259 163.7
[M]+ 271.02737 159.7
[M]- 271.02847 159.7
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

No patent data available for this compound.