CID 25248268

1018165-70-2

Structural Information

Molecular Formula
C10H16N2O
SMILES
CCC1=NOC(=C1C2CCCN2)C
InChI
InChI=1S/C10H16N2O/c1-3-8-10(7(2)13-12-8)9-5-4-6-11-9/h9,11H,3-6H2,1-2H3
InChIKey
CALHICVWQHHBRQ-UHFFFAOYSA-N
Compound name
3-ethyl-5-methyl-4-pyrrolidin-2-yl-1,2-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.12627 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.133546 140.6
[M+Na]+ 203.115488 148.1
[M-H]- 179.118994 144.0
[M+NH4]+ 198.160093 159.6
[M+K]+ 219.089428 146.7
[M+H-H2O]+ 163.123530 133.8
[M+HCOO]- 225.124471 160.1
[M+CH3COO]- 239.140121 178.0
[M+Na-2H]- 201.100936 142.3
[M]+ 180.12572142 138.9
[M]- 180.12681858 138.9
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.