CID 137321712

Schembl11850235

Structural Information

Molecular Formula

C₁₀H₁₆N₂O₂

SMILES

CC1CC(CC2(C1)C(=O)NC(=N)O2)C

InChI

InChI=1S/C10H16N2O2/c1-6-3-7(2)5-10(4-6)8(13)12-9(11)14-10/h6-7H,3-5H2,1-2H3,(H2,11,12,13)

InChIKey

OCLPDFZMHGEFPC-UHFFFAOYSA-N

Compound name

2-imino-7,9-dimethyl-1-oxa-3-azaspiro[4.5]decan-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 196.12119 Da
Monoisotopic Mass: 2.1
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]+	197.128466	143.1
[M+Na]+	219.110408	150.0
[M-H]-	195.113914	146.6
[M+NH4]+	214.155013	163.2
[M+K]+	235.084348	147.8
[M+H-H2O]+	179.118450	137.7
[M+HCOO]-	241.119391	160.3
[M+CH3COO]-	255.135041	182.5
[M+Na-2H]-	217.095856	146.4
[M]+	196.12064142	136.6
[M]-	196.12173858	136.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe