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

12
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

literature stripe

Patent stripe

patents stripe