CID 28808664

4,5,6,7-tetrahydro-1h-indazole-3-carbaldehyde

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

C1CCC2=C(C1)C(=NN2)C=O

InChI

InChI=1S/C8H10N2O/c11-5-8-6-3-1-2-4-7(6)9-10-8/h5H,1-4H2,(H,9,10)

InChIKey

BPKNULLUAAKXPC-UHFFFAOYSA-N

Compound name

4,5,6,7-tetrahydro-1H-indazole-3-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 150.07932 Da
Monoisotopic Mass: 1.2
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]+	151.08660	131.3
[M+Na]+	173.06854	142.5
[M+NH4]+	168.11314	139.7
[M+K]+	189.04248	138.2
[M-H]-	149.07204	131.6
[M+Na-2H]-	171.05399	135.7
[M]+	150.07877	132.7
[M]-	150.07987	132.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe