CID 105454166

1222368-76-4

Structural Information

Molecular Formula

C₁₁H₁₀N₂O₂

SMILES

C1CC1C2=C3C=C(C=CC3=NN2)C(=O)O

InChI

InChI=1S/C11H10N2O2/c14-11(15)7-3-4-9-8(5-7)10(13-12-9)6-1-2-6/h3-6H,1-2H2,(H,12,13)(H,14,15)

InChIKey

YIRTUZMXPMVWAY-UHFFFAOYSA-N

Compound name

3-cyclopropyl-2H-indazole-5-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 202.07423 Da
Monoisotopic Mass: 1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	203.08151	144.4
[M+Na]+	225.06345	156.1
[M-H]-	201.06695	148.3
[M+NH4]+	220.10805	157.7
[M+K]+	241.03739	150.0
[M+H-H2O]+	185.07149	137.6
[M+HCOO]-	247.07243	164.8
[M+CH3COO]-	261.08808	156.8
[M+Na-2H]-	223.04890	149.6
[M]+	202.07368	146.7
[M]-	202.07478	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe