CID 26568

14208-99-2

Structural Information

Molecular Formula

C₁₄H₂₅NO

SMILES

C1C2CC3CC1CC(C2)(C3)CCNCCO

InChI

InChI=1S/C14H25NO/c16-4-3-15-2-1-14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13,15-16H,1-10H2

InChIKey

UOZOWNRPSKKJCB-UHFFFAOYSA-N

Compound name

2-[2-(1-adamantyl)ethylamino]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 223.19362 Da
Monoisotopic Mass: 2.9
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]+	224.20090	154.0
[M+Na]+	246.18284	154.4
[M-H]-	222.18634	147.5
[M+NH4]+	241.22744	178.2
[M+K]+	262.15678	150.6
[M+H-H2O]+	206.19088	148.0
[M+HCOO]-	268.19182	160.4
[M+CH3COO]-	282.20747	161.4
[M+Na-2H]-	244.16829	164.5
[M]+	223.19307	153.1
[M]-	223.19417	153.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe