CID 4170708

Benzamide, 4-chloro-n-2-propenyl-

Structural Information

Molecular Formula
C10H10ClNO
SMILES
C=CCNC(=O)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C10H10ClNO/c1-2-7-12-10(13)8-3-5-9(11)6-4-8/h2-6H,1,7H2,(H,12,13)
InChIKey
HRELSTHYEFXOCT-UHFFFAOYSA-N
Compound name
4-chloro-N-prop-2-enylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

9
Patents

195.04509 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.05237 140.1
[M+Na]+ 218.03431 148.4
[M-H]- 194.03781 143.8
[M+NH4]+ 213.07891 160.3
[M+K]+ 234.00825 143.9
[M+H-H2O]+ 178.04235 135.2
[M+HCOO]- 240.04329 160.5
[M+CH3COO]- 254.05894 184.5
[M+Na-2H]- 216.01976 145.7
[M]+ 195.04454 141.4
[M]- 195.04564 141.4
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.