CID 145874542

2-methoxy-6-(1h-pyrazol-1-yl)benzaldehyde

Structural Information

Molecular Formula
C11H10N2O2
SMILES
COC1=CC=CC(=C1C=O)N2C=CC=N2
InChI
InChI=1S/C11H10N2O2/c1-15-11-5-2-4-10(9(11)8-14)13-7-3-6-12-13/h2-8H,1H3
InChIKey
HNOQJGLLZXZNBR-UHFFFAOYSA-N
Compound name
2-methoxy-6-pyrazol-1-ylbenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.07423 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.08151 141.2
[M+Na]+ 225.06345 151.2
[M-H]- 201.06695 146.0
[M+NH4]+ 220.10805 159.6
[M+K]+ 241.03739 148.4
[M+H-H2O]+ 185.07149 133.2
[M+HCOO]- 247.07243 165.5
[M+CH3COO]- 261.08808 183.8
[M+Na-2H]- 223.04890 146.9
[M]+ 202.07368 144.0
[M]- 202.07478 144.0
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.