CID 6371880

Nsc634302

Structural Information

Molecular Formula
C18H33NO2Si
SMILES
CCCC/C=C(/C1C(C2CCCN2C(=O)O1)(C)C)\[Si](C)(C)C
InChI
InChI=1S/C18H33NO2Si/c1-7-8-9-11-14(22(4,5)6)16-18(2,3)15-12-10-13-19(15)17(20)21-16/h11,15-16H,7-10,12-13H2,1-6H3/b14-11-
InChIKey
ZDPRMDJAWOCYLO-KAMYIIQDSA-N
Compound name
4,4-dimethyl-3-[(Z)-1-trimethylsilylhex-1-enyl]-4a,5,6,7-tetrahydro-3H-pyrrolo[1,2-c][1,3]oxazin-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.22806 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.23534 180.2
[M+Na]+ 346.21728 185.1
[M-H]- 322.22078 182.5
[M+NH4]+ 341.26188 197.7
[M+K]+ 362.19122 182.7
[M+H-H2O]+ 306.22532 174.9
[M+HCOO]- 368.22626 192.0
[M+CH3COO]- 382.24191 209.1
[M+Na-2H]- 344.20273 179.7
[M]+ 323.22751 180.3
[M]- 323.22861 180.3
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.