CID 139022619

2344685-74-9

Structural Information

Molecular Formula

C₉H₁₈N₂O

SMILES

CN1CC2(C1)CCNCC2CO

InChI

InChI=1S/C9H18N2O/c1-11-6-9(7-11)2-3-10-4-8(9)5-12/h8,10,12H,2-7H2,1H3

InChIKey

YMZJCBSDGZKBDI-UHFFFAOYSA-N

Compound name

(2-methyl-2,7-diazaspiro[3.5]nonan-5-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 170.1419 Da
Monoisotopic Mass: -0.6
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]+	171.149176	139.6
[M+Na]+	193.131118	144.1
[M-H]-	169.134624	139.2
[M+NH4]+	188.175723	151.9
[M+K]+	209.105058	144.4
[M+H-H2O]+	153.139160	128.5
[M+HCOO]-	215.140101	152.8
[M+CH3COO]-	229.155751	177.4
[M+Na-2H]-	191.116566	144.3
[M]+	170.14135142	141.3
[M]-	170.14244858	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.