CID 75531171

1212103-66-6

Structural Information

Molecular Formula

C₆H₁₄N₂O

SMILES

CN1C[C@H]([C@@H](C1)OC)N

InChI

InChI=1S/C6H14N2O/c1-8-3-5(7)6(4-8)9-2/h5-6H,3-4,7H2,1-2H3/t5-,6-/m1/s1

InChIKey

OHPHQGOFOZCOHP-PHDIDXHHSA-N

Compound name

(3R,4R)-4-methoxy-1-methylpyrrolidin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 130.11061 Da
Monoisotopic Mass: -0.9
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]+	131.11789	127.4
[M+Na]+	153.09983	134.9
[M-H]-	129.10333	129.3
[M+NH4]+	148.14443	149.8
[M+K]+	169.07377	134.4
[M+H-H2O]+	113.10787	121.6
[M+HCOO]-	175.10881	150.0
[M+CH3COO]-	189.12446	174.1
[M+Na-2H]-	151.08528	130.8
[M]+	130.11006	124.9
[M]-	130.11116	124.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe