CID 121552842

1909336-06-6

Structural Information

Molecular Formula

C₁₃H₂₄N₂O₂

SMILES

CC(C)(C)OC(=O)NCC1CNCC12CCC2

InChI

InChI=1S/C13H24N2O2/c1-12(2,3)17-11(16)15-8-10-7-14-9-13(10)5-4-6-13/h10,14H,4-9H2,1-3H3,(H,15,16)

InChIKey

JSQIERZWKALRIT-UHFFFAOYSA-N

Compound name

tert-butyl N-(6-azaspiro[3.4]octan-8-ylmethyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 240.18378 Da
Monoisotopic Mass: 1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	241.19106	161.8
[M+Na]+	263.17300	163.2
[M+NH4]+	258.21760	165.5
[M+K]+	279.14694	161.2
[M-H]-	239.17650	158.6
[M+Na-2H]-	261.15845	162.2
[M]+	240.18323	159.6
[M]-	240.18433	159.6

Literature stripe

literature stripe

Patent stripe

patents stripe