CID 28064634

1015846-42-0

Structural Information

Molecular Formula

C₉H₁₈N₂O

SMILES

C1CC1(CN)CN2CCOCC2

InChI

InChI=1S/C9H18N2O/c10-7-9(1-2-9)8-11-3-5-12-6-4-11/h1-8,10H2

InChIKey

IVQHZQNJTYWCNZ-UHFFFAOYSA-N

Compound name

[1-(morpholin-4-ylmethyl)cyclopropyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 170.1419 Da
Monoisotopic Mass: -0.4
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]+	171.14918	141.1
[M+Na]+	193.13112	147.5
[M-H]-	169.13462	146.7
[M+NH4]+	188.17572	155.2
[M+K]+	209.10506	147.3
[M+H-H2O]+	153.13916	134.2
[M+HCOO]-	215.14010	159.9
[M+CH3COO]-	229.15575	182.6
[M+Na-2H]-	191.11657	147.8
[M]+	170.14135	139.3
[M]-	170.14245	139.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe