CID 45051

63887-50-3

Structural Information

Molecular Formula
C16H21NO2
SMILES
C=CCOC1=CC=CC=C1C(=O)NC2CCCCC2
InChI
InChI=1S/C16H21NO2/c1-2-12-19-15-11-7-6-10-14(15)16(18)17-13-8-4-3-5-9-13/h2,6-7,10-11,13H,1,3-5,8-9,12H2,(H,17,18)
InChIKey
UYODDCKMZFCTPB-UHFFFAOYSA-N
Compound name
N-cyclohexyl-2-prop-2-enoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.15723 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.16451 161.5
[M+Na]+ 282.14645 164.5
[M-H]- 258.14995 166.7
[M+NH4]+ 277.19105 177.3
[M+K]+ 298.12039 161.0
[M+H-H2O]+ 242.15449 153.5
[M+HCOO]- 304.15543 181.7
[M+CH3COO]- 318.17108 197.7
[M+Na-2H]- 280.13190 164.0
[M]+ 259.15668 157.4
[M]- 259.15778 157.4
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