CID 54593193

1260663-66-8

Structural Information

Molecular Formula
C6H9N3O
SMILES
C1COCC2=C1NN=C2N
InChI
InChI=1S/C6H9N3O/c7-6-4-3-10-2-1-5(4)8-9-6/h1-3H2,(H3,7,8,9)
InChIKey
DVNGOOLQHQHDIA-UHFFFAOYSA-N
Compound name
1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

139.07455 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08183 126.3
[M+Na]+ 162.06377 136.7
[M+NH4]+ 157.10837 134.6
[M+K]+ 178.03771 134.0
[M-H]- 138.06727 128.3
[M+Na-2H]- 160.04922 130.2
[M]+ 139.07400 128.0
[M]- 139.07510 128.0
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

patents stripe