CID 83848459

2416230-74-3

Structural Information

Molecular Formula
C11H17N3O
SMILES
C1CC(CNC1)C2=NNC3=C2COCC3
InChI
InChI=1S/C11H17N3O/c1-2-8(6-12-4-1)11-9-7-15-5-3-10(9)13-14-11/h8,12H,1-7H2,(H,13,14)
InChIKey
RXBHBZSXORPXRM-UHFFFAOYSA-N
Compound name
3-piperidin-3-yl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.13716 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.14444 147.6
[M+Na]+ 230.12638 151.9
[M-H]- 206.12988 147.6
[M+NH4]+ 225.17098 161.8
[M+K]+ 246.10032 148.4
[M+H-H2O]+ 190.13442 138.7
[M+HCOO]- 252.13536 158.6
[M+CH3COO]- 266.15101 156.8
[M+Na-2H]- 228.11183 151.0
[M]+ 207.13661 138.3
[M]- 207.13771 138.3
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.