CID 3016599

N-ethyl-2-isopropyl-2,3-dimethylbutyramide

Structural Information

Molecular Formula
C11H23NO
SMILES
CCNC(=O)C(C)(C(C)C)C(C)C
InChI
InChI=1S/C11H23NO/c1-7-12-10(13)11(6,8(2)3)9(4)5/h8-9H,7H2,1-6H3,(H,12,13)
InChIKey
MLGQKMLAQSNRSE-UHFFFAOYSA-N
Compound name
N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

185.17796 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.185236 147.4
[M+Na]+ 208.167178 152.0
[M-H]- 184.170684 147.5
[M+NH4]+ 203.211783 167.3
[M+K]+ 224.141118 152.1
[M+H-H2O]+ 168.175220 142.8
[M+HCOO]- 230.176161 166.6
[M+CH3COO]- 244.191811 190.4
[M+Na-2H]- 206.152626 149.1
[M]+ 185.17741142 148.1
[M]- 185.17850858 148.1
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

patents stripe