CID 71756633

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-n-(pyrrolidin-3-yl)acetamide hydrochloride

Structural Information

Molecular Formula
C12H19N3O2
SMILES
CCC1=CN=C(O1)CN(C2CCNC2)C(=O)C
InChI
InChI=1S/C12H19N3O2/c1-3-11-7-14-12(17-11)8-15(9(2)16)10-4-5-13-6-10/h7,10,13H,3-6,8H2,1-2H3
InChIKey
XLHVTMIWGVEINH-UHFFFAOYSA-N
Compound name
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-pyrrolidin-3-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.14772 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.15500 156.5
[M+Na]+ 260.13694 161.3
[M-H]- 236.14044 160.8
[M+NH4]+ 255.18154 172.9
[M+K]+ 276.11088 161.1
[M+H-H2O]+ 220.14498 148.4
[M+HCOO]- 282.14592 176.2
[M+CH3COO]- 296.16157 192.6
[M+Na-2H]- 258.12239 156.5
[M]+ 237.14717 155.6
[M]- 237.14827 155.6
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.