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]+ 309.21728 172.7
[M+Na]+ 331.19922 178.2
[M-H]- 307.20272 178.1
[M+NH4]+ 326.24382 197.5
[M+K]+ 347.17316 178.7
[M+H-H2O]+ 291.20726 170.1
[M+HCOO]- 353.20820 192.2
[M+CH3COO]- 367.22385 219.5
[M+Na-2H]- 329.18467 170.8
[M]+ 308.20945 176.3
[M]- 308.21055 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.