CID 9575549

Benzenecarboximidamide, 4-bromo-2-methyl-n'-[(1-naphthalenylcarbonyl)oxy]-

Structural Information

Molecular Formula
C19H15BrN2O2
SMILES
CC1=C(C=CC(=C1)Br)/C(=N\OC(=O)C2=CC=CC3=CC=CC=C32)/N
InChI
InChI=1S/C19H15BrN2O2/c1-12-11-14(20)9-10-15(12)18(21)22-24-19(23)17-8-4-6-13-5-2-3-7-16(13)17/h2-11H,1H3,(H2,21,22)
InChIKey
FBWCMSHIMNNURT-UHFFFAOYSA-N
Compound name
[(E)-[amino-(4-bromo-2-methylphenyl)methylidene]amino] naphthalene-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

382.03168 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.03896 182.3
[M+Na]+ 405.02090 191.4
[M-H]- 381.02440 192.5
[M+NH4]+ 400.06550 198.1
[M+K]+ 420.99484 179.4
[M+H-H2O]+ 365.02894 179.1
[M+HCOO]- 427.02988 203.3
[M+CH3COO]- 441.04553 220.7
[M+Na-2H]- 403.00635 186.9
[M]+ 382.03113 200.6
[M]- 382.03223 200.6
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.