CID 15129218

125290-87-1

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₂

SMILES

CC1(CCNC1)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C11H22N2O2/c1-10(2,3)15-9(14)13-8-11(4)5-6-12-7-11/h12H,5-8H2,1-4H3,(H,13,14)

InChIKey

AXCFIJFQUMHJRG-UHFFFAOYSA-N

Compound name

tert-butyl N-[(3-methylpyrrolidin-3-yl)methyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 97
Patents: 214.16812 Da
Monoisotopic Mass: 1.3
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]+	215.17540	151.6
[M+Na]+	237.15734	157.8
[M+NH4]+	232.20194	159.0
[M+K]+	253.13128	154.3
[M-H]-	213.16084	150.3
[M+Na-2H]-	235.14279	155.0
[M]+	214.16757	151.8
[M]-	214.16867	151.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe