CID 67066664

4-[(5-methyl-1h-pyrazol-3-yl)oxy]aniline

Structural Information

Molecular Formula
C10H11N3O
SMILES
CC1=CC(=NN1)OC2=CC=C(C=C2)N
InChI
InChI=1S/C10H11N3O/c1-7-6-10(13-12-7)14-9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)
InChIKey
CVFMPFRLYWOSCT-UHFFFAOYSA-N
Compound name
4-[(5-methyl-1H-pyrazol-3-yl)oxy]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

189.09021 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.097486 139.3
[M+Na]+ 212.079428 148.1
[M-H]- 188.082934 142.3
[M+NH4]+ 207.124033 157.0
[M+K]+ 228.053368 144.3
[M+H-H2O]+ 172.087470 131.4
[M+HCOO]- 234.088411 162.3
[M+CH3COO]- 248.104061 181.2
[M+Na-2H]- 210.064876 144.5
[M]+ 189.08966142 137.4
[M]- 189.09075858 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

patents stripe