CID 106340

1,3,5-triazine-2,4-disulfenamide, 6-(diethylamino)-

Structural Information

Molecular Formula
C7H14N6S2
SMILES
CCN(CC)C1=NC(=NC(=N1)SN)SN
InChI
InChI=1S/C7H14N6S2/c1-3-13(4-2)5-10-6(14-8)12-7(11-5)15-9/h3-4,8-9H2,1-2H3
InChIKey
GTFMKVOQSNCACD-UHFFFAOYSA-N
Compound name
S-[4-aminosulfanyl-6-(diethylamino)-1,3,5-triazin-2-yl]thiohydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

246.07214 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.07942 147.8
[M+Na]+ 269.06136 155.9
[M-H]- 245.06486 147.8
[M+NH4]+ 264.10596 161.5
[M+K]+ 285.03530 150.9
[M+H-H2O]+ 229.06940 139.5
[M+HCOO]- 291.07034 160.0
[M+CH3COO]- 305.08599 201.0
[M+Na-2H]- 267.04681 149.4
[M]+ 246.07159 148.8
[M]- 246.07269 148.8
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

patents stripe