CID 43510302

84460-89-9

Structural Information

Molecular Formula
C13H18N2O
SMILES
C1CC(C2=CC=CC=C2C1)C(=O)NCCN
InChI
InChI=1S/C13H18N2O/c14-8-9-15-13(16)12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,12H,3,5,7-9,14H2,(H,15,16)
InChIKey
ASNYEBSCXSIDAC-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.1419 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.149176 148.7
[M+Na]+ 241.131118 153.1
[M-H]- 217.134624 151.8
[M+NH4]+ 236.175723 167.2
[M+K]+ 257.105058 149.8
[M+H-H2O]+ 201.139160 141.9
[M+HCOO]- 263.140101 169.8
[M+CH3COO]- 277.155751 193.2
[M+Na-2H]- 239.116566 153.9
[M]+ 218.14135142 143.9
[M]- 218.14244858 143.9
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.