CID 63301299

N-methyl-n-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}pyrrolidin-3-amine

Structural Information

Molecular Formula
C11H20N4O
SMILES
CC(C)C1=NC(=NO1)CN(C)C2CCNC2
InChI
InChI=1S/C11H20N4O/c1-8(2)11-13-10(14-16-11)7-15(3)9-4-5-12-6-9/h8-9,12H,4-7H2,1-3H3
InChIKey
JYGNWOJOJUJRKU-UHFFFAOYSA-N
Compound name
N-methyl-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.16371 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.17099 153.6
[M+Na]+ 247.15293 158.6
[M-H]- 223.15643 156.7
[M+NH4]+ 242.19753 169.4
[M+K]+ 263.12687 158.7
[M+H-H2O]+ 207.16097 144.7
[M+HCOO]- 269.16191 172.0
[M+CH3COO]- 283.17756 191.9
[M+Na-2H]- 245.13838 153.9
[M]+ 224.16316 152.4
[M]- 224.16426 152.4
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.