CID 278297

28487-84-5

Structural Information

Molecular Formula
C14H19N3O2
SMILES
CC1CCC2=C(C1)C(=NN2)CC3CC(=O)NC(=O)C3
InChI
InChI=1S/C14H19N3O2/c1-8-2-3-11-10(4-8)12(17-16-11)5-9-6-13(18)15-14(19)7-9/h8-9H,2-7H2,1H3,(H,16,17)(H,15,18,19)
InChIKey
GVSBETTZOOUJNC-UHFFFAOYSA-N
Compound name
4-[(5-methyl-4,5,6,7-tetrahydro-1H-indazol-3-yl)methyl]piperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.14774 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.15502 164.0
[M+Na]+ 284.13696 170.0
[M-H]- 260.14046 164.1
[M+NH4]+ 279.18156 177.9
[M+K]+ 300.11090 164.2
[M+H-H2O]+ 244.14500 155.4
[M+HCOO]- 306.14594 175.3
[M+CH3COO]- 320.16159 172.8
[M+Na-2H]- 282.12241 163.2
[M]+ 261.14719 156.3
[M]- 261.14829 156.3
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.