CID 62414741

N-[(1-methyl-1h-pyrazol-5-yl)methyl]cyclobutanamine dihydrochloride

Structural Information

Molecular Formula
C9H15N3
SMILES
CN1C(=CC=N1)CNC2CCC2
InChI
InChI=1S/C9H15N3/c1-12-9(5-6-11-12)7-10-8-3-2-4-8/h5-6,8,10H,2-4,7H2,1H3
InChIKey
QAPBOWJVYCXSFH-UHFFFAOYSA-N
Compound name
N-[(2-methylpyrazol-3-yl)methyl]cyclobutanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.13388 135.5
[M+Na]+ 188.11582 141.6
[M+NH4]+ 183.16042 139.8
[M+K]+ 204.08976 139.3
[M-H]- 164.11932 135.2
[M+Na-2H]- 186.10127 139.5
[M]+ 165.12605 134.8
[M]- 165.12715 134.8
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.

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No patent data available for this compound.