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]+ 208.144436 147.6
[M+Na]+ 230.126378 151.9
[M-H]- 206.129884 147.6
[M+NH4]+ 225.170983 161.8
[M+K]+ 246.100318 148.4
[M+H-H2O]+ 190.134420 138.7
[M+HCOO]- 252.135361 158.6
[M+CH3COO]- 266.151011 156.8
[M+Na-2H]- 228.111826 151.0
[M]+ 207.13661142 138.3
[M]- 207.13770858 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.