CID 146095528

2411252-57-6

Structural Information

Molecular Formula
C6H14N2OS
SMILES
CC1(CNCCS1(=N)=O)C
InChI
InChI=1S/C6H14N2OS/c1-6(2)5-8-3-4-10(6,7)9/h7-8H,3-5H2,1-2H3
InChIKey
ROZBIBMOFQUHTE-UHFFFAOYSA-N
Compound name
1-imino-2,2-dimethyl-1,4-thiazinane 1-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.08269 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.08997 129.7
[M+Na]+ 185.07191 137.2
[M-H]- 161.07541 130.6
[M+NH4]+ 180.11651 152.5
[M+K]+ 201.04585 134.5
[M+H-H2O]+ 145.07995 125.7
[M+HCOO]- 207.08089 144.2
[M+CH3COO]- 221.09654 172.9
[M+Na-2H]- 183.05736 135.3
[M]+ 162.08214 125.6
[M]- 162.08324 125.6
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.