CID 2777595

Methyl 3-hydrazinothiophene-2-carboxylate

Structural Information

Molecular Formula
C6H8N2O2S
SMILES
COC(=O)C1=C(C=CS1)NN
InChI
InChI=1S/C6H8N2O2S/c1-10-6(9)5-4(8-7)2-3-11-5/h2-3,8H,7H2,1H3
InChIKey
RWGYQWWIXLVGDJ-UHFFFAOYSA-N
Compound name
methyl 3-hydrazinylthiophene-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

172.03065 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.03793 134.9
[M+Na]+ 195.01987 142.9
[M+NH4]+ 190.06447 142.7
[M+K]+ 210.99381 138.8
[M-H]- 171.02337 136.4
[M+Na-2H]- 193.00532 138.8
[M]+ 172.03010 136.5
[M]- 172.03120 136.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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