CID 141416048

5-(1-methyl-1h-pyrazol-5-yl)-1h-1,2,3,4-tetrazole

Structural Information

Molecular Formula
C5H6N6
SMILES
CN1C(=CC=N1)C2=NNN=N2
InChI
InChI=1S/C5H6N6/c1-11-4(2-3-6-11)5-7-9-10-8-5/h2-3H,1H3,(H,7,8,9,10)
InChIKey
GOBIANOHSVKISD-UHFFFAOYSA-N
Compound name
5-(2-methylpyrazol-3-yl)-2H-tetrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.0654 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.072676 127.8
[M+Na]+ 173.054618 139.7
[M-H]- 149.058124 126.8
[M+NH4]+ 168.099223 143.7
[M+K]+ 189.028558 136.9
[M+H-H2O]+ 133.062660 118.0
[M+HCOO]- 195.063601 148.4
[M+CH3COO]- 209.079251 141.0
[M+Na-2H]- 171.040066 134.3
[M]+ 150.06485142 128.4
[M]- 150.06594858 128.4
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.