CID 2760898

198989-07-0

Structural Information

Molecular Formula

C₁₀H₁₈N₂O₂

SMILES

CC(C)(C)OC(=O)N1CC2CC1CN2

InChI

InChI=1S/C10H18N2O2/c1-10(2,3)14-9(13)12-6-7-4-8(12)5-11-7/h7-8,11H,4-6H2,1-3H3

InChIKey

UXAWXZDXVOYLII-UHFFFAOYSA-N

Compound name

tert-butyl 2,5-diazabicyclo[2.2.1]heptane-2-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 4508
Patents: 198.13683 Da
Monoisotopic Mass: 0.7
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]+	199.14411	146.0
[M+Na]+	221.12605	152.6
[M+NH4]+	216.17065	152.8
[M+K]+	237.09999	152.9
[M-H]-	197.12955	142.9
[M+Na-2H]-	219.11150	145.3
[M]+	198.13628	145.6
[M]-	198.13738	145.6

Literature stripe

literature stripe

Patent stripe

patents stripe