CID 138039719

2241130-86-7

Structural Information

Molecular Formula
C14H23NO3
SMILES
CC(C)(C)OC(=O)NCC1CCC2(C1=O)CCC2
InChI
InChI=1S/C14H23NO3/c1-13(2,3)18-12(17)15-9-10-5-8-14(11(10)16)6-4-7-14/h10H,4-9H2,1-3H3,(H,15,17)
InChIKey
YFQFBZNKAAXHAY-UHFFFAOYSA-N
Compound name
tert-butyl N-[(8-oxospiro[3.4]octan-7-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.1678 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.17508 159.9
[M+Na]+ 276.15702 163.1
[M-H]- 252.16052 164.9
[M+NH4]+ 271.20162 174.2
[M+K]+ 292.13096 164.7
[M+H-H2O]+ 236.16506 150.5
[M+HCOO]- 298.16600 178.1
[M+CH3COO]- 312.18165 197.7
[M+Na-2H]- 274.14247 162.1
[M]+ 253.16725 167.3
[M]- 253.16835 167.3
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.