CID 3059509

10-undecenamide, n-(4-nitrophenyl)-

Structural Information

Molecular Formula
C17H24N2O3
SMILES
C=CCCCCCCCCC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C17H24N2O3/c1-2-3-4-5-6-7-8-9-10-17(20)18-15-11-13-16(14-12-15)19(21)22/h2,11-14H,1,3-10H2,(H,18,20)
InChIKey
KUMYSKHGAQHCMQ-UHFFFAOYSA-N
Compound name
N-(4-nitrophenyl)undec-10-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.17868 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.185956 176.0
[M+Na]+ 327.167898 179.0
[M-H]- 303.171404 178.3
[M+NH4]+ 322.212503 189.6
[M+K]+ 343.141838 171.1
[M+H-H2O]+ 287.175940 172.7
[M+HCOO]- 349.176881 199.6
[M+CH3COO]- 363.192531 202.9
[M+Na-2H]- 325.153346 179.1
[M]+ 304.17813142 176.5
[M]- 304.17922858 176.5
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

No patent data available for this compound.