CID 145913429

2377034-44-9

Structural Information

Molecular Formula
C12H19N3O2
SMILES
CCN1C=C2C(=N1)C(CC3(O2)CCNCC3)O
InChI
InChI=1S/C12H19N3O2/c1-2-15-8-10-11(14-15)9(16)7-12(17-10)3-5-13-6-4-12/h8-9,13,16H,2-7H2,1H3
InChIKey
DFOTYKXPVLPZDU-UHFFFAOYSA-N
Compound name
2-ethylspiro[6,7-dihydropyrano[3,2-c]pyrazole-5,4'-piperidine]-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.14772 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.154996 155.9
[M+Na]+ 260.136938 162.4
[M-H]- 236.140444 155.7
[M+NH4]+ 255.181543 171.9
[M+K]+ 276.110878 159.1
[M+H-H2O]+ 220.144980 147.7
[M+HCOO]- 282.145921 166.7
[M+CH3COO]- 296.161571 165.5
[M+Na-2H]- 258.122386 159.8
[M]+ 237.14717142 149.9
[M]- 237.14826858 149.9
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.