CID 95970483

1909288-47-6

Structural Information

Molecular Formula
C11H19N3O
SMILES
CC1=C(C(=NN1C)C)[C@H]2[C@@H](CCO2)CN
InChI
InChI=1S/C11H19N3O/c1-7-10(8(2)14(3)13-7)11-9(6-12)4-5-15-11/h9,11H,4-6,12H2,1-3H3/t9-,11+/m0/s1
InChIKey
ULNUKJVDCAEMRH-GXSJLCMTSA-N
Compound name
[(2R,3S)-2-(1,3,5-trimethylpyrazol-4-yl)oxolan-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.15282 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.16010 148.6
[M+Na]+ 232.14204 158.7
[M+NH4]+ 227.18664 156.0
[M+K]+ 248.11598 157.6
[M-H]- 208.14554 152.0
[M+Na-2H]- 230.12749 152.0
[M]+ 209.15227 150.7
[M]- 209.15337 150.7
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.