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]+ 243.06990 147.5
[M+Na]+ 265.05184 158.6
[M-H]- 241.05534 153.4
[M+NH4]+ 260.09644 165.4
[M+K]+ 281.02578 152.7
[M+H-H2O]+ 225.05988 139.9
[M+HCOO]- 287.06082 168.7
[M+CH3COO]- 301.07647 160.7
[M+Na-2H]- 263.03729 154.3
[M]+ 242.06207 149.1
[M]- 242.06317 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.