CID 124709636

Rac-(3r,4s)-4-(1h-1,2,3-triazol-1-yl)oxolan-3-amine dihydrochloride

Structural Information

Molecular Formula
C6H10N4O
SMILES
C1[C@H]([C@H](CO1)N2C=CN=N2)N
InChI
InChI=1S/C6H10N4O/c7-5-3-11-4-6(5)10-2-1-8-9-10/h1-2,5-6H,3-4,7H2/t5-,6+/m1/s1
InChIKey
MXZGJMZVGJMDBZ-RITPCOANSA-N
Compound name
(3S,4R)-4-(triazol-1-yl)oxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.08546 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.092736 129.6
[M+Na]+ 177.074678 137.4
[M-H]- 153.078184 132.7
[M+NH4]+ 172.119283 148.0
[M+K]+ 193.048618 137.3
[M+H-H2O]+ 137.082720 121.3
[M+HCOO]- 199.083661 151.0
[M+CH3COO]- 213.099311 142.8
[M+Na-2H]- 175.060126 133.9
[M]+ 154.08491142 126.8
[M]- 154.08600858 126.8
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.