CID 61256127

[6-(propan-2-yloxy)pyridazin-3-yl]methanol hydrochloride

Structural Information

Molecular Formula
C8H12N2O2
SMILES
CC(C)OC1=NN=C(C=C1)CO
InChI
InChI=1S/C8H12N2O2/c1-6(2)12-8-4-3-7(5-11)9-10-8/h3-4,6,11H,5H2,1-2H3
InChIKey
YADCRSYJNFOYON-UHFFFAOYSA-N
Compound name
(6-propan-2-yloxypyridazin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.08987 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.097146 135.3
[M+Na]+ 191.079088 143.4
[M-H]- 167.082594 135.1
[M+NH4]+ 186.123693 152.6
[M+K]+ 207.053028 142.0
[M+H-H2O]+ 151.087130 128.2
[M+HCOO]- 213.088071 155.5
[M+CH3COO]- 227.103721 177.1
[M+Na-2H]- 189.064536 141.7
[M]+ 168.08932142 136.6
[M]- 168.09041858 136.6
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.