CID 3038886

41957-25-9

Structural Information

Molecular Formula
C17H18N2O
SMILES
CN1CCC2=C(C1)C=CC=C2NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C17H18N2O/c1-19-11-10-15-14(12-19)8-5-9-16(15)18-17(20)13-6-3-2-4-7-13/h2-9H,10-12H2,1H3,(H,18,20)
InChIKey
XGMDBMXEIAXDGE-UHFFFAOYSA-N
Compound name
N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

266.1419 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.14918 162.7
[M+Na]+ 289.13112 176.7
[M+NH4]+ 284.17572 171.8
[M+K]+ 305.10506 168.3
[M-H]- 265.13462 168.1
[M+Na-2H]- 287.11657 171.2
[M]+ 266.14135 166.3
[M]- 266.14245 166.3
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

patents stripe