CID 75511479

4-(pyrrolidin-1-yl)oxane-4-carboxamide

Structural Information

Molecular Formula
C10H18N2O2
SMILES
C1CCN(C1)C2(CCOCC2)C(=O)N
InChI
InChI=1S/C10H18N2O2/c11-9(13)10(3-7-14-8-4-10)12-5-1-2-6-12/h1-8H2,(H2,11,13)
InChIKey
XZLQKPCDHDAOKC-UHFFFAOYSA-N
Compound name
4-pyrrolidin-1-yloxane-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.13683 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.144106 145.6
[M+Na]+ 221.126048 148.7
[M-H]- 197.129554 149.7
[M+NH4]+ 216.170653 164.4
[M+K]+ 237.099988 148.6
[M+H-H2O]+ 181.134090 138.7
[M+HCOO]- 243.135031 162.6
[M+CH3COO]- 257.150681 182.2
[M+Na-2H]- 219.111496 148.3
[M]+ 198.13628142 138.0
[M]- 198.13737858 138.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.