CID 24837751

N-((4-hydroxy-3-methoxyphenyl)methyl)-9-dodecenamide (z)-

Structural Information

Molecular Formula
C20H31NO3
SMILES
CC/C=C\CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
InChI
InChI=1S/C20H31NO3/c1-3-4-5-6-7-8-9-10-11-12-20(23)21-16-17-13-14-18(22)19(15-17)24-2/h4-5,13-15,22H,3,6-12,16H2,1-2H3,(H,21,23)/b5-4-
InChIKey
AWAHVRWEZOHAQI-PLNGDYQASA-N
Compound name
(Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]dodec-9-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

333.2304 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.23768 185.5
[M+Na]+ 356.21962 189.0
[M-H]- 332.22312 186.3
[M+NH4]+ 351.26422 198.6
[M+K]+ 372.19356 184.4
[M+H-H2O]+ 316.22766 177.7
[M+HCOO]- 378.22860 205.9
[M+CH3COO]- 392.24425 213.0
[M+Na-2H]- 354.20507 185.0
[M]+ 333.22985 189.6
[M]- 333.23095 189.6
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