CID 2777620

19786-56-2

Structural Information

Molecular Formula
C7H8N4S
SMILES
CC1=CSC2=NC=NC(=C12)NN
InChI
InChI=1S/C7H8N4S/c1-4-2-12-7-5(4)6(11-8)9-3-10-7/h2-3H,8H2,1H3,(H,9,10,11)
InChIKey
IWRWDRZDFILWMR-UHFFFAOYSA-N
Compound name
(5-methylthieno[2,3-d]pyrimidin-4-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

180.04697 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.05425 131.8
[M+Na]+ 203.03619 143.4
[M-H]- 179.03969 134.7
[M+NH4]+ 198.08079 152.6
[M+K]+ 219.01013 139.5
[M+H-H2O]+ 163.04423 125.4
[M+HCOO]- 225.04517 152.9
[M+CH3COO]- 239.06082 146.0
[M+Na-2H]- 201.02164 138.2
[M]+ 180.04642 133.9
[M]- 180.04752 133.9
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