CID 25220770

1-(pyrrolidin-2-ylmethyl)-1h-pyrazole

Structural Information

Molecular Formula
C8H13N3
SMILES
C1CC(NC1)CN2C=CC=N2
InChI
InChI=1S/C8H13N3/c1-3-8(9-4-1)7-11-6-2-5-10-11/h2,5-6,8-9H,1,3-4,7H2
InChIKey
NROSSDZFPHQESU-UHFFFAOYSA-N
Compound name
1-(pyrrolidin-2-ylmethyl)pyrazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

151.11095 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.11823 133.8
[M+Na]+ 174.10017 143.8
[M+NH4]+ 169.14477 141.8
[M+K]+ 190.07411 141.6
[M-H]- 150.10367 134.7
[M+Na-2H]- 172.08562 139.6
[M]+ 151.11040 135.2
[M]- 151.11150 135.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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