CID 1614737

2,4-dichloro-n-[(1z)-3-oxo-1-phenyl-3-(prop-2-en-1-ylamino)prop-1-en-2-yl]benzamide

Structural Information

Molecular Formula
C19H16Cl2N2O2
SMILES
C=CCNC(=O)/C(=C/C1=CC=CC=C1)/NC(=O)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C19H16Cl2N2O2/c1-2-10-22-19(25)17(11-13-6-4-3-5-7-13)23-18(24)15-9-8-14(20)12-16(15)21/h2-9,11-12H,1,10H2,(H,22,25)(H,23,24)/b17-11-
InChIKey
OLVUHPQORFPVJF-BOPFTXTBSA-N
Compound name
2,4-dichloro-N-[(Z)-3-oxo-1-phenyl-3-(prop-2-enylamino)prop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.05887 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.06615 186.8
[M+Na]+ 397.04809 193.1
[M-H]- 373.05159 192.4
[M+NH4]+ 392.09269 199.4
[M+K]+ 413.02203 185.2
[M+H-H2O]+ 357.05613 180.2
[M+HCOO]- 419.05707 200.3
[M+CH3COO]- 433.07272 218.5
[M+Na-2H]- 395.03354 186.7
[M]+ 374.05832 189.0
[M]- 374.05942 189.0
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.