CID 11609787

87206-01-7

Structural Information

Molecular Formula
C20H37NO3
SMILES
CCCCCCCCCCCCCCCC(=O)N[C@H]1CCOC1=O
InChI
InChI=1S/C20H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)21-18-16-17-24-20(18)23/h18H,2-17H2,1H3,(H,21,22)/t18-/m0/s1
InChIKey
QJIXVOQAEZMUIH-SFHVURJKSA-N
Compound name
N-[(3S)-2-oxooxolan-3-yl]hexadecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

339.27734 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.28462 191.9
[M+Na]+ 362.26656 192.7
[M-H]- 338.27006 193.4
[M+NH4]+ 357.31116 205.4
[M+K]+ 378.24050 190.2
[M+H-H2O]+ 322.27460 184.2
[M+HCOO]- 384.27554 210.6
[M+CH3COO]- 398.29119 215.7
[M+Na-2H]- 360.25201 189.4
[M]+ 339.27679 196.0
[M]- 339.27789 196.0
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