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]+ 340.35741 199.8
[M+Na]+ 362.33935 199.5
[M-H]- 338.34285 198.8
[M+NH4]+ 357.38395 213.9
[M+K]+ 378.31329 197.6
[M+H-H2O]+ 322.34739 192.1
[M+HCOO]- 384.34833 217.3
[M+CH3COO]- 398.36398 226.3
[M+Na-2H]- 360.32480 193.9
[M]+ 339.34958 206.3
[M]- 339.35068 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