CID 708739

35970-80-0

Structural Information

Molecular Formula
C12H10N4S
SMILES
C1=CC=C(C=C1)C2=CC3=C(N=CN=C3S2)NN
InChI
InChI=1S/C12H10N4S/c13-16-11-9-6-10(8-4-2-1-3-5-8)17-12(9)15-7-14-11/h1-7H,13H2,(H,14,15,16)
InChIKey
UAOUEAFHRAFLKS-UHFFFAOYSA-N
Compound name
(6-phenylthieno[2,3-d]pyrimidin-4-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.06262 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.069896 147.5
[M+Na]+ 265.051838 158.6
[M-H]- 241.055344 153.4
[M+NH4]+ 260.096443 165.4
[M+K]+ 281.025778 152.7
[M+H-H2O]+ 225.059880 139.9
[M+HCOO]- 287.060821 168.7
[M+CH3COO]- 301.076471 160.7
[M+Na-2H]- 263.037286 154.3
[M]+ 242.06207142 149.1
[M]- 242.06316858 149.1
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.