CID 147743570

2413866-79-0

Structural Information

Molecular Formula
C13H23NO3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(CO)C=C
InChI
InChI=1S/C13H23NO3/c1-5-13(10-15)6-8-14(9-7-13)11(16)17-12(2,3)4/h5,15H,1,6-10H2,2-4H3
InChIKey
HAUSYEIOQNCISI-UHFFFAOYSA-N
Compound name
tert-butyl 4-ethenyl-4-(hydroxymethyl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.1678 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.17508 158.1
[M+Na]+ 264.15702 163.1
[M-H]- 240.16052 158.2
[M+NH4]+ 259.20162 175.8
[M+K]+ 280.13096 161.6
[M+H-H2O]+ 224.16506 153.1
[M+HCOO]- 286.16600 172.8
[M+CH3COO]- 300.18165 188.7
[M+Na-2H]- 262.14247 161.2
[M]+ 241.16725 156.2
[M]- 241.16835 156.2
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.