CID 132496173

Cyano[cyclohexyl(methyl)oxo-lambda6-sulfanylidene]amine

Structural Information

Molecular Formula
C8H14N2OS
SMILES
CS(=NC#N)(=O)C1CCCCC1
InChI
InChI=1S/C8H14N2OS/c1-12(11,10-7-9)8-5-3-2-4-6-8/h8H,2-6H2,1H3
InChIKey
PMNOLNOAOUCWMO-UHFFFAOYSA-N
Compound name
(cyclohexyl-methyl-oxo-lambda6-sulfanylidene)cyanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.08269 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08997 145.5
[M+Na]+ 209.07191 153.4
[M-H]- 185.07541 150.1
[M+NH4]+ 204.11651 164.0
[M+K]+ 225.04585 151.3
[M+H-H2O]+ 169.07995 133.4
[M+HCOO]- 231.08089 159.1
[M+CH3COO]- 245.09654 194.1
[M+Na-2H]- 207.05736 148.9
[M]+ 186.08214 138.8
[M]- 186.08324 138.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.