CID 203325

2-pyrrolidinone, 1-(6-(1-pyrrolidinyl)hexyl)-

Structural Information

Molecular Formula
C14H26N2O
SMILES
C1CCN(C1)CCCCCCN2CCCC2=O
InChI
InChI=1S/C14H26N2O/c17-14-8-7-13-16(14)12-4-2-1-3-9-15-10-5-6-11-15/h1-13H2
InChIKey
NGYDKMMXCKGTNN-UHFFFAOYSA-N
Compound name
1-(6-pyrrolidin-1-ylhexyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.20451 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.21179 161.6
[M+Na]+ 261.19373 164.9
[M-H]- 237.19723 163.8
[M+NH4]+ 256.23833 179.5
[M+K]+ 277.16767 162.4
[M+H-H2O]+ 221.20177 152.9
[M+HCOO]- 283.20271 179.4
[M+CH3COO]- 297.21836 191.5
[M+Na-2H]- 259.17918 159.5
[M]+ 238.20396 158.5
[M]- 238.20506 158.5
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.