CID 3043317

Brn 0526329

Structural Information

Molecular Formula
C7H10N6S
SMILES
CC1=C2C(=NC(=N1)N)SCC(=N2)NN
InChI
InChI=1S/C7H10N6S/c1-3-5-6(12-7(8)10-3)14-2-4(11-5)13-9/h2,9H2,1H3,(H,11,13)(H2,8,10,12)
InChIKey
QXHBRJVCBGLUJB-UHFFFAOYSA-N
Compound name
6-hydrazinyl-4-methyl-7H-pyrimido[4,5-b][1,4]thiazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.06877 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07605 140.9
[M+Na]+ 233.05799 150.6
[M-H]- 209.06149 141.3
[M+NH4]+ 228.10259 156.7
[M+K]+ 249.03193 145.8
[M+H-H2O]+ 193.06603 133.4
[M+HCOO]- 255.06697 157.4
[M+CH3COO]- 269.08262 152.5
[M+Na-2H]- 231.04344 147.2
[M]+ 210.06822 138.5
[M]- 210.06932 138.5
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

No patent data available for this compound.