CID 10329737

613675-34-6

Structural Information

Molecular Formula

C₈H₁₄N₂O₂

SMILES

CN1CC2(CCNCC2)OC1=O

InChI

InChI=1S/C8H14N2O2/c1-10-6-8(12-7(10)11)2-4-9-5-3-8/h9H,2-6H2,1H3

InChIKey

JDMUQPZSWZFNMW-UHFFFAOYSA-N

Compound name

3-methyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 53
Patents: 170.10553 Da
Monoisotopic Mass: -0.2
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]+	171.112806	136.9
[M+Na]+	193.094748	143.3
[M-H]-	169.098254	138.5
[M+NH4]+	188.139353	156.4
[M+K]+	209.068688	142.4
[M+H-H2O]+	153.102790	130.3
[M+HCOO]-	215.103731	152.3
[M+CH3COO]-	229.119381	172.7
[M+Na-2H]-	191.080196	141.6
[M]+	170.10498142	130.8
[M]-	170.10607858	130.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe