CID 361059

N-cyclopropanoyl loline

Structural Information

Molecular Formula
C12H18N2O2
SMILES
CN(C1C2CN3C1C(O2)CC3)C(=O)C4CC4
InChI
InChI=1S/C12H18N2O2/c1-13(12(15)7-2-3-7)10-9-6-14-5-4-8(16-9)11(10)14/h7-11H,2-6H2,1H3
InChIKey
FXYHMIWPEOUVQP-UHFFFAOYSA-N
Compound name
N-methyl-N-(2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-yl)cyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.13683 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.14411 150.3
[M+Na]+ 245.12605 158.0
[M-H]- 221.12955 157.4
[M+NH4]+ 240.17065 169.0
[M+K]+ 261.09999 156.1
[M+H-H2O]+ 205.13409 145.6
[M+HCOO]- 267.13503 167.7
[M+CH3COO]- 281.15068 162.5
[M+Na-2H]- 243.11150 150.9
[M]+ 222.13628 154.0
[M]- 222.13738 154.0
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.