CID 20099299

3-methyl-1-(prop-2-en-1-yl)piperazin-2-one

Structural Information

Molecular Formula
C8H14N2O
SMILES
CC1C(=O)N(CCN1)CC=C
InChI
InChI=1S/C8H14N2O/c1-3-5-10-6-4-9-7(2)8(10)11/h3,7,9H,1,4-6H2,2H3
InChIKey
LQQNTPXRLLYUKK-UHFFFAOYSA-N
Compound name
3-methyl-1-prop-2-enylpiperazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.11061 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.11789 135.2
[M+Na]+ 177.09983 142.1
[M-H]- 153.10333 134.2
[M+NH4]+ 172.14443 153.1
[M+K]+ 193.07377 139.3
[M+H-H2O]+ 137.10787 128.7
[M+HCOO]- 199.10881 152.2
[M+CH3COO]- 213.12446 174.7
[M+Na-2H]- 175.08528 139.0
[M]+ 154.11006 130.4
[M]- 154.11116 130.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.