CID 137935636

2253619-67-7

Structural Information

Molecular Formula
C5H10N4O
SMILES
C[C@@H](C1=NNC(=N1)CN)O
InChI
InChI=1S/C5H10N4O/c1-3(10)5-7-4(2-6)8-9-5/h3,10H,2,6H2,1H3,(H,7,8,9)/t3-/m0/s1
InChIKey
PLADLFAYNCTNHO-VKHMYHEASA-N
Compound name
(1S)-1-[5-(aminomethyl)-1H-1,2,4-triazol-3-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.08546 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.09274 128.7
[M+Na]+ 165.07468 137.5
[M+NH4]+ 160.11928 134.6
[M+K]+ 181.04862 136.4
[M-H]- 141.07818 127.0
[M+Na-2H]- 163.06013 132.1
[M]+ 142.08491 128.9
[M]- 142.08601 128.9
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.