CID 135553024

69049-02-1

Structural Information

Molecular Formula
C4H6N4O
SMILES
C1CC1N2C(=O)NN=N2
InChI
InChI=1S/C4H6N4O/c9-4-5-6-7-8(4)3-1-2-3/h3H,1-2H2,(H,5,7,9)
InChIKey
GUTNODKBPXZJOD-UHFFFAOYSA-N
Compound name
4-cyclopropyl-1H-tetrazol-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

126.05416 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.06144 128.4
[M+Na]+ 149.04338 141.3
[M+NH4]+ 144.08798 135.5
[M+K]+ 165.01732 139.7
[M-H]- 125.04688 134.6
[M+Na-2H]- 147.02883 136.5
[M]+ 126.05361 132.7
[M]- 126.05471 132.7
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