CID 2777568

3-chloro-4-methyl-2-thiophenecarboxylic acid hydrazide

Structural Information

Molecular Formula

C₆H₇ClN₂OS

SMILES

CC1=CSC(=C1Cl)C(=O)NN

InChI

InChI=1S/C6H7ClN2OS/c1-3-2-11-5(4(3)7)6(10)9-8/h2H,8H2,1H3,(H,9,10)

InChIKey

COSDURBTTAEVMV-UHFFFAOYSA-N

Compound name

3-chloro-4-methylthiophene-2-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 189.99677 Da
Monoisotopic Mass: 1.5
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]+	191.004046	137.8
[M+Na]+	212.985988	147.4
[M-H]-	188.989494	142.0
[M+NH4]+	208.030593	160.1
[M+K]+	228.959928	143.3
[M+H-H2O]+	172.994030	133.4
[M+HCOO]-	234.994971	154.7
[M+CH3COO]-	249.010621	182.7
[M+Na-2H]-	210.971436	138.6
[M]+	189.99622142	139.6
[M]-	189.99731858	139.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe