CID 96737048

2165740-80-5

Structural Information

Molecular Formula
C9H15N3
SMILES
CN1C(=CC=N1)C[C@H]2CCCN2
InChI
InChI=1S/C9H15N3/c1-12-9(4-6-11-12)7-8-3-2-5-10-8/h4,6,8,10H,2-3,5,7H2,1H3/t8-/m1/s1
InChIKey
FBOYNKBMEFLVJT-MRVPVSSYSA-N
Compound name
1-methyl-5-[[(2R)-pyrrolidin-2-yl]methyl]pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.13388 138.0
[M+Na]+ 188.11582 148.2
[M+NH4]+ 183.16042 145.8
[M+K]+ 204.08976 145.9
[M-H]- 164.11932 139.0
[M+Na-2H]- 186.10127 143.2
[M]+ 165.12605 139.4
[M]- 165.12715 139.4
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.