CID 14230278

83898-63-9

Structural Information

Molecular Formula

C₈H₁₅N₃O

SMILES

CC1(NC(=O)C2N1CCNC2)C

InChI

InChI=1S/C8H15N3O/c1-8(2)10-7(12)6-5-9-3-4-11(6)8/h6,9H,3-5H2,1-2H3,(H,10,12)

InChIKey

IEYKCXJYWXSHCR-UHFFFAOYSA-N

Compound name

3,3-dimethyl-2,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyrazin-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 20
Patents: 169.1215 Da
Monoisotopic Mass: -0.5
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]+	170.128776	140.0
[M+Na]+	192.110718	147.5
[M-H]-	168.114224	137.3
[M+NH4]+	187.155323	160.0
[M+K]+	208.084658	144.0
[M+H-H2O]+	152.118760	133.5
[M+HCOO]-	214.119701	153.1
[M+CH3COO]-	228.135351	173.3
[M+Na-2H]-	190.096166	143.6
[M]+	169.12095142	133.0
[M]-	169.12204858	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe