CID 3066910

2-thiazoline, 2-(cyclohexylnitrosamino)-

Structural Information

Molecular Formula
C9H15N3OS
SMILES
C1CCC(CC1)N(C2=NCCS2)N=O
InChI
InChI=1S/C9H15N3OS/c13-11-12(9-10-6-7-14-9)8-4-2-1-3-5-8/h8H,1-7H2
InChIKey
OSLDVNIRADADBD-UHFFFAOYSA-N
Compound name
N-cyclohexyl-N-(4,5-dihydro-1,3-thiazol-2-yl)nitrous amide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.09358 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.100856 145.7
[M+Na]+ 236.082798 149.9
[M-H]- 212.086304 152.8
[M+NH4]+ 231.127403 165.4
[M+K]+ 252.056738 149.5
[M+H-H2O]+ 196.090840 137.5
[M+HCOO]- 258.091781 164.8
[M+CH3COO]- 272.107431 191.0
[M+Na-2H]- 234.068246 147.6
[M]+ 213.09303142 143.4
[M]- 213.09412858 143.4
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.