CID 253148

2-hydrazinyl-5-phenyl-1,3,4-thiadiazole

Structural Information

Molecular Formula
C8H8N4S
SMILES
C1=CC=C(C=C1)C2=NN=C(S2)NN
InChI
InChI=1S/C8H8N4S/c9-10-8-12-11-7(13-8)6-4-2-1-3-5-6/h1-5H,9H2,(H,10,12)
InChIKey
COYPLZXSHTZYFQ-UHFFFAOYSA-N
Compound name
(5-phenyl-1,3,4-thiadiazol-2-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

192.04697 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.05425 135.8
[M+Na]+ 215.03619 145.1
[M-H]- 191.03969 140.3
[M+NH4]+ 210.08079 154.3
[M+K]+ 231.01013 140.9
[M+H-H2O]+ 175.04423 128.0
[M+HCOO]- 237.04517 156.8
[M+CH3COO]- 251.06082 149.1
[M+Na-2H]- 213.02164 140.8
[M]+ 192.04642 135.0
[M]- 192.04752 135.0
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