CID 24837751

9-dodecenamide, n-((4-hydroxy-3-methoxyphenyl)methyl)-, (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]+ 334.237676 185.5
[M+Na]+ 356.219618 189.0
[M-H]- 332.223124 186.3
[M+NH4]+ 351.264223 198.6
[M+K]+ 372.193558 184.4
[M+H-H2O]+ 316.227660 177.7
[M+HCOO]- 378.228601 205.9
[M+CH3COO]- 392.244251 213.0
[M+Na-2H]- 354.205066 185.0
[M]+ 333.22985142 189.6
[M]- 333.23094858 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