CID 211087

2-methyl-1-pyrazolidinepropiono-2',6'-xylidide

Structural Information

Molecular Formula
C15H23N3O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)CCN2CCCN2C
InChI
InChI=1S/C15H23N3O/c1-12-6-4-7-13(2)15(12)16-14(19)8-11-18-10-5-9-17(18)3/h4,6-7H,5,8-11H2,1-3H3,(H,16,19)
InChIKey
TZOQYQFIVKVJRU-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-3-(2-methylpyrazolidin-1-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1841 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.19138 164.5
[M+Na]+ 284.17332 174.9
[M+NH4]+ 279.21792 171.4
[M+K]+ 300.14726 170.4
[M-H]- 260.17682 166.9
[M+Na-2H]- 282.15877 169.4
[M]+ 261.18355 166.4
[M]- 261.18465 166.4
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.

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No patent data available for this compound.