CID 114489

N-(1-methylundecyl)acrylamide

Structural Information

Molecular Formula
C15H29NO
SMILES
CCCCCCCCCCC(C)NC(=O)C=C
InChI
InChI=1S/C15H29NO/c1-4-6-7-8-9-10-11-12-13-14(3)16-15(17)5-2/h5,14H,2,4,6-13H2,1,3H3,(H,16,17)
InChIKey
ACALHKQKISMQQT-UHFFFAOYSA-N
Compound name
N-dodecan-2-ylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

741
Patents

239.22491 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.23219 165.7
[M+Na]+ 262.21413 168.5
[M-H]- 238.21763 164.5
[M+NH4]+ 257.25873 183.1
[M+K]+ 278.18807 166.0
[M+H-H2O]+ 222.22217 159.4
[M+HCOO]- 284.22311 186.2
[M+CH3COO]- 298.23876 200.4
[M+Na-2H]- 260.19958 165.6
[M]+ 239.22436 168.2
[M]- 239.22546 168.2
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