CID 111864

Einecs 273-148-9

Structural Information

Molecular Formula
C15H30N6S
SMILES
CC(C)(C)NC1=NC(=NC(=N1)SNC(C)(C)C)NC(C)(C)C
InChI
InChI=1S/C15H30N6S/c1-13(2,3)19-10-16-11(20-14(4,5)6)18-12(17-10)22-21-15(7,8)9/h21H,1-9H3,(H2,16,17,18,19,20)
InChIKey
XUINYYDBYPZYTB-UHFFFAOYSA-N
Compound name
2-N,4-N-ditert-butyl-6-(tert-butylamino)sulfanyl-1,3,5-triazine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.22528 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.23256 184.1
[M+Na]+ 349.21450 191.2
[M+NH4]+ 344.25910 188.7
[M+K]+ 365.18844 185.9
[M-H]- 325.21800 183.8
[M+Na-2H]- 347.19995 187.5
[M]+ 326.22473 185.3
[M]- 326.22583 185.3
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.