CID 155820170

1-(1-ethynylcyclopropyl)-1h-1,2,3-triazole

Structural Information

Molecular Formula
C7H7N3
SMILES
C#CC1(CC1)N2C=CN=N2
InChI
InChI=1S/C7H7N3/c1-2-7(3-4-7)10-6-5-8-9-10/h1,5-6H,3-4H2
InChIKey
UCKAIANZSAXTFG-UHFFFAOYSA-N
Compound name
1-(1-ethynylcyclopropyl)triazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

133.064 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.07128 131.7
[M+Na]+ 156.05322 144.8
[M+NH4]+ 151.09782 138.0
[M+K]+ 172.02716 137.3
[M-H]- 132.05672 131.5
[M+Na-2H]- 154.03867 139.2
[M]+ 133.06345 133.8
[M]- 133.06455 133.8
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.