CID 93664

N,n-bis(1-methylethyl)hexadecanamide

Structural Information

Molecular Formula
C22H45NO
SMILES
CCCCCCCCCCCCCCCC(=O)N(C(C)C)C(C)C
InChI
InChI=1S/C22H45NO/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(24)23(20(2)3)21(4)5/h20-21H,6-19H2,1-5H3
InChIKey
SPFIEWHOPDAJLI-UHFFFAOYSA-N
Compound name
N,N-di(propan-2-yl)hexadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

339.35013 Da
Monoisotopic Mass

8.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.357406 199.8
[M+Na]+ 362.339348 199.5
[M-H]- 338.342854 198.8
[M+NH4]+ 357.383953 213.9
[M+K]+ 378.313288 197.6
[M+H-H2O]+ 322.347390 192.1
[M+HCOO]- 384.348331 217.3
[M+CH3COO]- 398.363981 226.3
[M+Na-2H]- 360.324796 193.9
[M]+ 339.34958142 206.3
[M]- 339.35067858 206.3
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