CID 105501545

1638771-32-0

Structural Information

Molecular Formula
C13H21NO3
SMILES
CC(C)(C)OC(=O)NC1CC2CCC(C1)C2=O
InChI
InChI=1S/C13H21NO3/c1-13(2,3)17-12(16)14-10-6-8-4-5-9(7-10)11(8)15/h8-10H,4-7H2,1-3H3,(H,14,16)
InChIKey
HLYGBCMBJPUFGL-UHFFFAOYSA-N
Compound name
tert-butyl N-(8-oxo-3-bicyclo[3.2.1]octanyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

239.15215 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.15943 154.9
[M+Na]+ 262.14137 161.6
[M+NH4]+ 257.18597 162.2
[M+K]+ 278.11531 159.3
[M-H]- 238.14487 154.1
[M+Na-2H]- 260.12682 154.9
[M]+ 239.15160 155.2
[M]- 239.15270 155.2
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

patents stripe