CID 24843739

Brn 2884243

Structural Information

Molecular Formula
C17H28N2O3
SMILES
CC(C(=O)N(C)C)N(C1C2CCC(C1=O)(C2(C)C)C)C(=O)C
InChI
InChI=1S/C17H28N2O3/c1-10(15(22)18(6)7)19(11(2)20)13-12-8-9-17(5,14(13)21)16(12,3)4/h10,12-13H,8-9H2,1-7H3
InChIKey
GTTAMIRBQGFZGJ-UHFFFAOYSA-N
Compound name
2-[acetyl-(4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanyl)amino]-N,N-dimethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.21 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.217276 172.7
[M+Na]+ 331.199218 178.2
[M-H]- 307.202724 178.1
[M+NH4]+ 326.243823 197.5
[M+K]+ 347.173158 178.7
[M+H-H2O]+ 291.207260 170.1
[M+HCOO]- 353.208201 192.2
[M+CH3COO]- 367.223851 219.5
[M+Na-2H]- 329.184666 170.8
[M]+ 308.20945142 176.3
[M]- 308.21054858 176.3
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.