CID 3060757

78239-31-3

Structural Information

Molecular Formula
C17H18N2O
SMILES
C1CC2=CC=CC=C2C1CCNC(=O)C3=CN=CC=C3
InChI
InChI=1S/C17H18N2O/c20-17(15-5-3-10-18-12-15)19-11-9-14-8-7-13-4-1-2-6-16(13)14/h1-6,10,12,14H,7-9,11H2,(H,19,20)
InChIKey
BWMCGIQHNVMBPP-UHFFFAOYSA-N
Compound name
N-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1419 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.14918 163.3
[M+Na]+ 289.13112 175.8
[M+NH4]+ 284.17572 172.1
[M+K]+ 305.10506 169.4
[M-H]- 265.13462 167.9
[M+Na-2H]- 287.11657 171.0
[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

No patent data available for this compound.