CID 56750

Brn 0700842

Structural Information

Molecular Formula
C19H35N3O3
SMILES
CCCCOCCC1=C(ON=C1C)NC(=O)C(C(C)C)N(CC)CC
InChI
InChI=1S/C19H35N3O3/c1-7-10-12-24-13-11-16-15(6)21-25-19(16)20-18(23)17(14(4)5)22(8-2)9-3/h14,17H,7-13H2,1-6H3,(H,20,23)
InChIKey
JFMMCZTXNNPIMB-UHFFFAOYSA-N
Compound name
N-[4-(2-butoxyethyl)-3-methyl-1,2-oxazol-5-yl]-2-(diethylamino)-3-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.26785 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.27513 195.3
[M+Na]+ 376.25707 198.0
[M-H]- 352.26057 198.6
[M+NH4]+ 371.30167 207.7
[M+K]+ 392.23101 198.4
[M+H-H2O]+ 336.26511 186.6
[M+HCOO]- 398.26605 215.4
[M+CH3COO]- 412.28170 226.7
[M+Na-2H]- 374.24252 191.7
[M]+ 353.26730 202.7
[M]- 353.26840 202.7
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.