CID 10057657

3-methyl-3-sulfanylbutanehydrazide

Structural Information

Molecular Formula

C₅H₁₂N₂OS

SMILES

CC(C)(CC(=O)NN)S

InChI

InChI=1S/C5H12N2OS/c1-5(2,9)3-4(8)7-6/h9H,3,6H2,1-2H3,(H,7,8)

InChIKey

SRNHFGGOWAGEPZ-UHFFFAOYSA-N

Compound name

3-methyl-3-sulfanylbutanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 92
Patents: 148.06703 Da
Monoisotopic Mass: -0.4
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]+	149.07431	133.0
[M+Na]+	171.05625	140.0
[M+NH4]+	166.10085	140.3
[M+K]+	187.03019	134.8
[M-H]-	147.05975	132.4
[M+Na-2H]-	169.04170	135.2
[M]+	148.06648	133.9
[M]-	148.06758	133.9

Literature stripe

literature stripe

Patent stripe

patents stripe