CID 323178

Nsc282032

Structural Information

Molecular Formula
C3H7N5O
SMILES
C(CO)N1C(=NN=N1)N
InChI
InChI=1S/C3H7N5O/c4-3-5-6-7-8(3)1-2-9/h9H,1-2H2,(H2,4,5,7)
InChIKey
MDLBOPYCJZSTMS-UHFFFAOYSA-N
Compound name
2-(5-aminotetrazol-1-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

5
Patents

129.06506 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.07234 123.5
[M+Na]+ 152.05428 133.3
[M+NH4]+ 147.09888 129.3
[M+K]+ 168.02822 131.8
[M-H]- 128.05778 121.6
[M+Na-2H]- 150.03973 127.9
[M]+ 129.06451 123.8
[M]- 129.06561 123.8
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

patents stripe