CID 54983295

Tert-butyl 4-(2-methyloxiran-2-yl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C13H23NO3
SMILES
CC1(CO1)C2CCN(CC2)C(=O)OC(C)(C)C
InChI
InChI=1S/C13H23NO3/c1-12(2,3)17-11(15)14-7-5-10(6-8-14)13(4)9-16-13/h10H,5-9H2,1-4H3
InChIKey
HJIVKQJLFSRCJY-UHFFFAOYSA-N
Compound name
tert-butyl 4-(2-methyloxiran-2-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

241.1678 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.17508 160.1
[M+Na]+ 264.15702 167.1
[M-H]- 240.16052 166.4
[M+NH4]+ 259.20162 172.5
[M+K]+ 280.13096 167.6
[M+H-H2O]+ 224.16506 154.0
[M+HCOO]- 286.16600 175.3
[M+CH3COO]- 300.18165 193.7
[M+Na-2H]- 262.14247 164.6
[M]+ 241.16725 162.8
[M]- 241.16835 162.8
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

patents stripe