CID 2760978

58626-97-4

Structural Information

Molecular Formula

C₇H₁₀N₂S

SMILES

CSC1=CC=C(C=C1)NN

InChI

InChI=1S/C7H10N2S/c1-10-7-4-2-6(9-8)3-5-7/h2-5,9H,8H2,1H3

InChIKey

RMTYJLWDVSGYDC-UHFFFAOYSA-N

Compound name

(4-methylsulfanylphenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 187
Patents: 154.05647 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]+	155.063746	128.4
[M+Na]+	177.045688	136.1
[M-H]-	153.049194	132.0
[M+NH4]+	172.090293	149.4
[M+K]+	193.019628	133.0
[M+H-H2O]+	137.053730	122.5
[M+HCOO]-	199.054671	149.5
[M+CH3COO]-	213.070321	179.3
[M+Na-2H]-	175.031136	133.4
[M]+	154.05592142	127.6
[M]-	154.05701858	127.6

Literature stripe

literature stripe

Patent stripe

patents stripe