CID 19804

Brn 2617287

Structural Information

Molecular Formula

C₁₄H₁₉NO

SMILES

CN(C)C(=O)CC1=CC=CC2=C1CCCC2

InChI

InChI=1S/C14H19NO/c1-15(2)14(16)10-12-8-5-7-11-6-3-4-9-13(11)12/h5,7-8H,3-4,6,9-10H2,1-2H3

InChIKey

HJCHQUDUGMGPSE-UHFFFAOYSA-N

Compound name

N,N-dimethyl-2-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 217.14667 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	218.15395	149.9
[M+Na]+	240.13589	154.8
[M-H]-	216.13939	154.9
[M+NH4]+	235.18049	169.7
[M+K]+	256.10983	153.0
[M+H-H2O]+	200.14393	143.1
[M+HCOO]-	262.14487	170.7
[M+CH3COO]-	276.16052	195.3
[M+Na-2H]-	238.12134	154.4
[M]+	217.14612	148.4
[M]-	217.14722	148.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.