CID 21511721

37434-57-4

Structural Information

Molecular Formula
C7H15NS2
SMILES
CC1N(C(SC(S1)C)C)C
InChI
InChI=1S/C7H15NS2/c1-5-8(4)6(2)10-7(3)9-5/h5-7H,1-4H3
InChIKey
AZHPCHPZVNDJKI-UHFFFAOYSA-N
Compound name
2,4,5,6-tetramethyl-1,3,5-dithiazinane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

177.06459 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.07187 132.9
[M+Na]+ 200.05381 140.9
[M-H]- 176.05731 135.1
[M+NH4]+ 195.09841 153.1
[M+K]+ 216.02775 137.8
[M+H-H2O]+ 160.06185 127.6
[M+HCOO]- 222.06279 141.3
[M+CH3COO]- 236.07844 181.3
[M+Na-2H]- 198.03926 131.5
[M]+ 177.06404 132.5
[M]- 177.06514 132.5
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

patents stripe