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]+ 219.14918 148.7
[M+Na]+ 241.13112 153.1
[M-H]- 217.13462 151.8
[M+NH4]+ 236.17572 167.2
[M+K]+ 257.10506 149.8
[M+H-H2O]+ 201.13916 141.9
[M+HCOO]- 263.14010 169.8
[M+CH3COO]- 277.15575 193.2
[M+Na-2H]- 239.11657 153.9
[M]+ 218.14135 143.9
[M]- 218.14245 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.