CID 2724126

Tempo

Structural Information

Molecular Formula

SMILES

CC1(CCCC(N1[O])(C)C)C

InChI

InChI=1S/C9H18NO/c1-8(2)6-5-7-9(3,4)10(8)11/h5-7H2,1-4H3

InChIKey

QYTDEUPAUMOIOP-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 1038
References: 108
Patents: 156.13884 Da
Monoisotopic Mass: 1.4
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]+	157.146116	132.3
[M+Na]+	179.128058	140.4
[M-H]-	155.131564	135.0
[M+NH4]+	174.172663	156.6
[M+K]+	195.101998	140.5
[M+H-H2O]+	139.136100	128.1
[M+HCOO]-	201.137041	151.6
[M+CH3COO]-	215.152691	178.7
[M+Na-2H]-	177.113506	138.9
[M]+	156.13829142	131.5
[M]-	156.13938858	131.5

Literature stripe

literature stripe

Patent stripe

patents stripe