CID 64089898

1-methyl-4-[(pyrrolidin-2-yl)methyl]-1h-pyrazole

Structural Information

Molecular Formula
C9H15N3
SMILES
CN1C=C(C=N1)CC2CCCN2
InChI
InChI=1S/C9H15N3/c1-12-7-8(6-11-12)5-9-3-2-4-10-9/h6-7,9-10H,2-5H2,1H3
InChIKey
ZBFJXJJLHWFPPQ-UHFFFAOYSA-N
Compound name
1-methyl-4-(pyrrolidin-2-ylmethyl)pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.6
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.

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No literature data available for this compound.

Patent stripe

No patent data available for this compound.