CID 75485535

2172548-13-7

Structural Information

Molecular Formula
C6H10N4O
SMILES
C1C(CN1)N2C=C(N=N2)CO
InChI
InChI=1S/C6H10N4O/c11-4-5-3-10(9-8-5)6-1-7-2-6/h3,6-7,11H,1-2,4H2
InChIKey
VUPXRFREZQRQCV-UHFFFAOYSA-N
Compound name
[1-(azetidin-3-yl)triazol-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.08546 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.09274 130.3
[M+Na]+ 177.07468 136.3
[M+NH4]+ 172.11928 132.6
[M+K]+ 193.04862 135.9
[M-H]- 153.07818 126.7
[M+Na-2H]- 175.06013 132.8
[M]+ 154.08491 128.5
[M]- 154.08601 128.5
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.